Product OPENEYE NAME: 4,6-dimethyl-3,5-dinitro-5-pentyl-cyclohexa-1,3-diene-1-carboxylate
CAS Name: 4,6-dimethyl-3,5-dinitro-5-pentyl-1-cyclohexa-1,3-dienecarboxylate
IUPAC NAME: 4,6-dimethyl-3,5-dinitro-5-pentylcyclohexa-1,3-diene-1-carboxylate
SYSTEMATIC NAME: 4,6-dimethyl-3,5-dinitro-5-pentyl-cyclohexa-1,3-diene-1-carboxylate
MOLECULAR FORMULA: C14H19N2O6-
MOLECULAR WEIGHT: 311.31046
SMILES: CCCCCC1(C(C(=CC(=C1C)[N+](=O)[O-])C(=O)[O-])C)[N+](=O)[O-]
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Product OPENEYE NAME: 4,6-dimethyl-3,5-dinitro-5-pentyl-cyclohexa-1,3-diene-1-carboxylic acid
CAS Name: 4,6-dimethyl-3,5-dinitro-5-pentyl-1-cyclohexa-1,3-dienecarboxylic acid
IUPAC NAME: 4,6-dimethyl-3,5-dinitro-5-pentylcyclohexa-1,3-diene-1-carboxylic acid
SYSTEMATIC NAME: 4,6-dimethyl-3,5-dinitro-5-pentyl-cyclohexa-1,3-diene-1-carboxylic acid
MOLECULAR FORMULA: C14H20N2O6
MOLECULAR WEIGHT: 312.3184
SMILES: CCCCCC1(C(C(=CC(=C1C)[N+](=O)[O-])C(=O)O)C)[N+](=O)[O-]
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Product OPENEYE NAME: 2-propoxyethyl 3,5-dinitrobenzoate
CAS Name: 3,5-dinitrobenzoic acid 2-propoxyethyl ester
IUPAC NAME: 2-propoxyethyl 3,5-dinitrobenzoate
SYSTEMATIC NAME: 2-propoxyethyl 3,5-dinitrobenzoate
MOLECULAR FORMULA: C12H14N2O7
MOLECULAR WEIGHT: 298.24876
SMILES: CCCOCCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: 3,7-dimethyloctyl 3,5-dinitrobenzoate
CAS Name: 3,5-dinitrobenzoic acid 3,7-dimethyloctyl ester
IUPAC NAME: 3,7-dimethyloctyl 3,5-dinitrobenzoate
SYSTEMATIC NAME: 3,7-dimethyloctyl 3,5-dinitrobenzoate
MOLECULAR FORMULA: C17H24N2O6
MOLECULAR WEIGHT: 352.38226
SMILES: CC(C)CCCC(C)CCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: 1-butyl-5-methyl-3,5-dinitro-cyclohex-2-ene-1-carboxylate
CAS Name: 1-butyl-5-methyl-3,5-dinitro-1-cyclohex-2-enecarboxylate
IUPAC NAME: 1-butyl-5-methyl-3,5-dinitrocyclohex-2-ene-1-carboxylate
SYSTEMATIC NAME: 1-butyl-5-methyl-3,5-dinitro-cyclohex-2-ene-1-carboxylate
MOLECULAR FORMULA: C12H17N2O6-
MOLECULAR WEIGHT: 285.27318
SMILES: CCCCC1(CC(CC(=C1)[N+](=O)[O-])(C)[N+](=O)[O-])C(=O)[O-]
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Product OPENEYE NAME: 1-butyl-5-methyl-3,5-dinitro-cyclohex-2-ene-1-carboxylic acid
CAS Name: 1-butyl-5-methyl-3,5-dinitro-1-cyclohex-2-enecarboxylic acid
IUPAC NAME: 1-butyl-5-methyl-3,5-dinitrocyclohex-2-ene-1-carboxylic acid
SYSTEMATIC NAME: 1-butyl-5-methyl-3,5-dinitro-cyclohex-2-ene-1-carboxylic acid
MOLECULAR FORMULA: C12H18N2O6
MOLECULAR WEIGHT: 286.28112
SMILES: CCCCC1(CC(CC(=C1)[N+](=O)[O-])(C)[N+](=O)[O-])C(=O)O
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Product OPENEYE NAME: 2-(2-butoxyethoxy)ethyl 3,5-dinitrobenzoate
CAS Name: 3,5-dinitrobenzoic acid 2-(2-butoxyethoxy)ethyl ester
IUPAC NAME: 2-(2-butoxyethoxy)ethyl 3,5-dinitrobenzoate
SYSTEMATIC NAME: 2-(2-butoxyethoxy)ethyl 3,5-dinitrobenzoate
MOLECULAR FORMULA: C15H20N2O8
MOLECULAR WEIGHT: 356.3279
SMILES: CCCCOCCOCCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: 2-(2-hexoxyethoxy)ethyl 3,5-dinitrobenzoate
CAS Name: 3,5-dinitrobenzoic acid 2-(2-hexoxyethoxy)ethyl ester
IUPAC NAME: 2-(2-hexoxyethoxy)ethyl 3,5-dinitrobenzoate
SYSTEMATIC NAME: 2-(2-hexoxyethoxy)ethyl 3,5-dinitrobenzoate
MOLECULAR FORMULA: C17H24N2O8
MOLECULAR WEIGHT: 384.38106
SMILES: CCCCCCOCCOCCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: 2-(2-methoxyethoxy)ethyl 3,5-dinitrobenzoate
CAS Name: 3,5-dinitrobenzoic acid 2-(2-methoxyethoxy)ethyl ester
IUPAC NAME: 2-(2-methoxyethoxy)ethyl 3,5-dinitrobenzoate
SYSTEMATIC NAME: 2-(2-methoxyethoxy)ethyl 3,5-dinitrobenzoate
MOLECULAR FORMULA: C12H14N2O8
MOLECULAR WEIGHT: 314.24816
SMILES: COCCOCCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: 4-(3-chlorophenyl)-6,7-dimethoxy-3-methyl-4H-isoquinolin-1-one
CAS Name: 4-(3-chlorophenyl)-6,7-dimethoxy-3-methyl-4H-isoquinolin-1-one
IUPAC NAME: 4-(3-chlorophenyl)-6,7-dimethoxy-3-methyl-4H-isoquinolin-1-one
SYSTEMATIC NAME: 4-(3-chlorophenyl)-6,7-dimethoxy-3-methyl-4H-isoquinolin-1-one
MOLECULAR FORMULA: C18H16ClNO3
MOLECULAR WEIGHT: 329.77754
SMILES: CC1=NC(=O)C2=CC(=C(C=C2C1C3=CC(=CC=C3)Cl)OC)OC
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Product OPENEYE NAME: 1-(3-chlorophenyl)-8-methoxy-4-methyl-5H-2,3-benzodiazepine
CAS Name: 1-(3-chlorophenyl)-8-methoxy-4-methyl-5H-2,3-benzodiazepine
IUPAC NAME: 1-(3-chlorophenyl)-8-methoxy-4-methyl-5H-2,3-benzodiazepine
SYSTEMATIC NAME: 1-(3-chlorophenyl)-8-methoxy-4-methyl-5H-2,3-benzodiazepine
MOLECULAR FORMULA: C17H15ClN2O
MOLECULAR WEIGHT: 298.7668
SMILES: CC1=NN=C(C2=C(C1)C=CC(=C2)OC)C3=CC(=CC=C3)Cl
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Product OPENEYE NAME: sodium nonyl 2-nonylnaphthalene-1-sulfonate
CAS Name: sodium 2-nonyl-1-naphthalenesulfonic acid nonyl ester
IUPAC NAME: sodium nonyl 2-nonylnaphthalene-1-sulfonate
SYSTEMATIC NAME: sodium nonyl 2-nonylnaphthalene-1-sulfonate
MOLECULAR FORMULA: C28H44NaO3S+
MOLECULAR WEIGHT: 483.70193
SMILES: CCCCCCCCCC1=C(C2=CC=CC=C2C=C1)S(=O)(=O)OCCCCCCCCC.[Na+]
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Product OPENEYE NAME: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanyl-2-propoxy-propanoic acid
CAS Name: 2-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]-2-propoxypropanoic acid
IUPAC NAME: 2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanyl-2-propoxypropanoic acid
SYSTEMATIC NAME: 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl-2-propoxy-propanoic acid
MOLECULAR FORMULA: C20H32O4S
MOLECULAR WEIGHT: 368.53068
SMILES: CCCOC(C)(C(=O)O)SC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C
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Product OPENEYE NAME: 4-[5-(2,4-dichloroanilino)-2,2-dimethyl-3,5-dioxo-pentoxy]benzoic acid
CAS Name: 4-[5-(2,4-dichloroanilino)-2,2-dimethyl-3,5-dioxopentoxy]benzoic acid
IUPAC NAME: 4-[5-(2,4-dichloroanilino)-2,2-dimethyl-3,5-dioxopentoxy]benzoic acid
SYSTEMATIC NAME: 4-[5-[(2,4-dichlorophenyl)amino]-2,2-dimethyl-3,5-bis(oxidanylidene)pentoxy]benzoic acid
MOLECULAR FORMULA: C20H19Cl2NO5
MOLECULAR WEIGHT: 424.27456
SMILES: CC(C)(COC1=CC=C(C=C1)C(=O)O)C(=O)CC(=O)NC2=C(C=C(C=C2)Cl)Cl
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Product OPENEYE NAME: methyl 4-[5-(2,4-dichloroanilino)-2,2-dimethyl-3,5-dioxo-pentoxy]benzoate
CAS Name: 4-[5-(2,4-dichloroanilino)-2,2-dimethyl-3,5-dioxopentoxy]benzoic acid methyl ester
IUPAC NAME: methyl 4-[5-(2,4-dichloroanilino)-2,2-dimethyl-3,5-dioxopentoxy]benzoate
SYSTEMATIC NAME: methyl 4-[5-[(2,4-dichlorophenyl)amino]-2,2-dimethyl-3,5-bis(oxidanylidene)pentoxy]benzoate
MOLECULAR FORMULA: C21H21Cl2NO5
MOLECULAR WEIGHT: 438.30114
SMILES: CC(C)(COC1=CC=C(C=C1)C(=O)OC)C(=O)CC(=O)NC2=C(C=C(C=C2)Cl)Cl
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Product OPENEYE NAME: N'-[2,4-dichloro-5-[4-(diethylamino)phenyl]-3-(3-oxopentanoyl)phenyl]acetohydrazide
CAS Name: N'-[2,4-dichloro-5-[4-(diethylamino)phenyl]-3-(1,3-dioxopentyl)phenyl]acetohydrazide
IUPAC NAME: N'-[2,4-dichloro-5-[4-(diethylamino)phenyl]-3-(3-oxopentanoyl)phenyl]acetohydrazide
SYSTEMATIC NAME: N'-[2,4-bis(chloranyl)-5-[4-(diethylamino)phenyl]-3-(3-oxidanylidenepentanoyl)phenyl]ethanehydrazide
MOLECULAR FORMULA: C23H27Cl2N3O3
MOLECULAR WEIGHT: 464.38478
SMILES: CCC(=O)CC(=O)C1=C(C(=CC(=C1Cl)NNC(=O)C)C2=CC=C(C=C2)N(CC)CC)Cl
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Product OPENEYE NAME: ethyl N-[5-(2,4-dichloroanilino)-3,5-dioxo-4-phenoxy-pentyl]carbamate
CAS Name: N-[5-(2,4-dichloroanilino)-3,5-dioxo-4-phenoxypentyl]carbamic acid ethyl ester
IUPAC NAME: ethyl N-[5-(2,4-dichloroanilino)-3,5-dioxo-4-phenoxypentyl]carbamate
SYSTEMATIC NAME: ethyl N-[5-[(2,4-dichlorophenyl)amino]-3,5-bis(oxidanylidene)-4-phenoxy-pentyl]carbamate
MOLECULAR FORMULA: C20H20Cl2N2O5
MOLECULAR WEIGHT: 439.2892
SMILES: CCOC(=O)NCCC(=O)C(C(=O)NC1=C(C=C(C=C1)Cl)Cl)OC2=CC=CC=C2
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Product OPENEYE NAME: benzyl N-[5-(2,4-dichloroanilino)-3,5-dioxo-4-phenoxy-pentyl]carbamate
CAS Name: N-[5-(2,4-dichloroanilino)-3,5-dioxo-4-phenoxypentyl]carbamic acid (phenylmethyl) ester
IUPAC NAME: benzyl N-[5-(2,4-dichloroanilino)-3,5-dioxo-4-phenoxypentyl]carbamate
SYSTEMATIC NAME: (phenylmethyl) N-[5-[(2,4-dichlorophenyl)amino]-3,5-bis(oxidanylidene)-4-phenoxy-pentyl]carbamate
MOLECULAR FORMULA: C25H22Cl2N2O5
MOLECULAR WEIGHT: 501.35858
SMILES: C1=CC=C(C=C1)COC(=O)NCCC(=O)C(C(=O)NC2=C(C=C(C=C2)Cl)Cl)OC3=CC=CC=C3
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Product OPENEYE NAME: 5-[N-acetyl-4-(diethylamino)anilino]-N-(2,4-dichlorophenyl)-3-oxo-2-phenoxy-pentanamide
CAS Name: 5-[N-acetyl-4-(diethylamino)anilino]-N-(2,4-dichlorophenyl)-3-oxo-2-phenoxypentanamide
IUPAC NAME: 5-[N-acetyl-4-(diethylamino)anilino]-N-(2,4-dichlorophenyl)-3-oxo-2-phenoxypentanamide
SYSTEMATIC NAME: N-(2,4-dichlorophenyl)-5-[[4-(diethylamino)phenyl]-ethanoyl-amino]-3-oxidanylidene-2-phenoxy-pentanamide
MOLECULAR FORMULA: C29H31Cl2N3O4
MOLECULAR WEIGHT: 556.48014
SMILES: CCN(CC)C1=CC=C(C=C1)N(CCC(=O)C(C(=O)NC2=C(C=C(C=C2)Cl)Cl)OC3=CC=CC=C3)C(=O)C
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Product OPENEYE NAME: N-[3-[4-(5-chloro-2-oxo-1-propyl-3,4-dihydroquinolin-3-yl)piperazin-1-yl]phenyl]acetamide hydrochloride
CAS Name: N-[3-[4-(5-chloro-2-oxo-1-propyl-3,4-dihydroquinolin-3-yl)-1-piperazinyl]phenyl]acetamide hydrochloride
IUPAC NAME: N-[3-[4-(5-chloro-2-oxo-1-propyl-3,4-dihydroquinolin-3-yl)piperazin-1-yl]phenyl]acetamide hydrochloride
SYSTEMATIC NAME: N-[3-[4-(5-chloranyl-2-oxidanylidene-1-propyl-3,4-dihydroquinolin-3-yl)piperazin-1-yl]phenyl]ethanamide hydrochloride
MOLECULAR FORMULA: C24H30Cl2N4O2
MOLECULAR WEIGHT: 477.4266
SMILES: CCCN1C2=C(CC(C1=O)N3CCN(CC3)C4=CC(=CC=C4)NC(=O)C)C(=CC=C2)Cl.Cl
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Product OPENEYE NAME: N-[3-[4-(5-chloro-2-oxo-1-propyl-3,4-dihydroquinolin-3-yl)piperazin-1-yl]phenyl]acetamide
CAS Name: N-[3-[4-(5-chloro-2-oxo-1-propyl-3,4-dihydroquinolin-3-yl)-1-piperazinyl]phenyl]acetamide
IUPAC NAME: N-[3-[4-(5-chloro-2-oxo-1-propyl-3,4-dihydroquinolin-3-yl)piperazin-1-yl]phenyl]acetamide
SYSTEMATIC NAME: N-[3-[4-(5-chloranyl-2-oxidanylidene-1-propyl-3,4-dihydroquinolin-3-yl)piperazin-1-yl]phenyl]ethanamide
MOLECULAR FORMULA: C24H29ClN4O2
MOLECULAR WEIGHT: 440.96566
SMILES: CCCN1C2=C(CC(C1=O)N3CCN(CC3)C4=CC(=CC=C4)NC(=O)C)C(=CC=C2)Cl
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