Product OPENEYE NAME: ethyl 2-chloro-2-oxo-acetate
CAS Name: 2-chloro-2-oxoacetic acid ethyl ester
IUPAC NAME: ethyl 2-chloro-2-oxoacetate
SYSTEMATIC NAME: ethyl 2-chloranyl-2-oxidanylidene-ethanoate
MOLECULAR FORMULA: C4H5ClO3
MOLECULAR WEIGHT: 136.5337
SMILES: CCOC(=O)C(=O)Cl
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Product OPENEYE NAME: 2-(2-hydroxy-4-methoxy-benzoyl)benzoic acid
CAS Name: 2-[(2-hydroxy-4-methoxyphenyl)-oxomethyl]benzoic acid
IUPAC NAME: 2-(2-hydroxy-4-methoxybenzoyl)benzoic acid
SYSTEMATIC NAME: 2-(4-methoxy-2-oxidanyl-phenyl)carbonylbenzoic acid
MOLECULAR FORMULA: C15H12O5
MOLECULAR WEIGHT: 272.25278
SMILES: COC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O)O
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Product OPENEYE NAME: 1,3-dibutylimidazolidin-2-one
CAS Name: 1,3-dibutyl-2-imidazolidinone
IUPAC NAME: 1,3-dibutylimidazolidin-2-one
SYSTEMATIC NAME: 1,3-dibutylimidazolidin-2-one
MOLECULAR FORMULA: C11H22N2O
MOLECULAR WEIGHT: 198.30518
SMILES: CCCCN1CCN(C1=O)CCCC
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Product OPENEYE NAME: 1-(diaminomethylene)-2-isopropyl-guanidine
CAS Name: 1-(diaminomethylidene)-2-propan-2-ylguanidine
IUPAC NAME: 1-(diaminomethylidene)-2-propan-2-ylguanidine
SYSTEMATIC NAME: 1-[bis(azanyl)methylidene]-2-propan-2-yl-guanidine
MOLECULAR FORMULA: C5H13N5
MOLECULAR WEIGHT: 143.19022
SMILES: CC(C)N=C(N)N=C(N)N
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Product OPENEYE NAME: 1-(diaminomethylene)-2-sec-butyl-guanidine
CAS Name: 2-butan-2-yl-1-(diaminomethylidene)guanidine
IUPAC NAME: 2-butan-2-yl-1-(diaminomethylidene)guanidine
SYSTEMATIC NAME: 1-[bis(azanyl)methylidene]-2-butan-2-yl-guanidine
MOLECULAR FORMULA: C6H15N5
MOLECULAR WEIGHT: 157.2168
SMILES: CCC(C)N=C(N)N=C(N)N
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Product OPENEYE NAME: 2-tert-butyl-1-(diaminomethylene)guanidine
CAS Name: 2-tert-butyl-1-(diaminomethylidene)guanidine
IUPAC NAME: 2-tert-butyl-1-(diaminomethylidene)guanidine
SYSTEMATIC NAME: 1-[bis(azanyl)methylidene]-2-tert-butyl-guanidine
MOLECULAR FORMULA: C6H15N5
MOLECULAR WEIGHT: 157.2168
SMILES: CC(C)(C)N=C(N)N=C(N)N
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Product OPENEYE NAME: 1-(diaminomethylene)-2-pentyl-guanidine
CAS Name: 1-(diaminomethylidene)-2-pentylguanidine
IUPAC NAME: 1-(diaminomethylidene)-2-pentylguanidine
SYSTEMATIC NAME: 1-[bis(azanyl)methylidene]-2-pentyl-guanidine
MOLECULAR FORMULA: C7H17N5
MOLECULAR WEIGHT: 171.24338
SMILES: CCCCCN=C(N)N=C(N)N
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Product OPENEYE NAME: 2-cyclohexyl-1-(diaminomethylene)guanidine
CAS Name: 2-cyclohexyl-1-(diaminomethylidene)guanidine
IUPAC NAME: 2-cyclohexyl-1-(diaminomethylidene)guanidine
SYSTEMATIC NAME: 1-[bis(azanyl)methylidene]-2-cyclohexyl-guanidine
MOLECULAR FORMULA: C8H17N5
MOLECULAR WEIGHT: 183.25408
SMILES: C1CCC(CC1)N=C(N)N=C(N)N
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Product OPENEYE NAME: 1-(5-nitro-1H-indol-3-yl)ethanone
CAS Name: 1-(5-nitro-1H-indol-3-yl)ethanone
IUPAC NAME: 1-(5-nitro-1H-indol-3-yl)ethanone
SYSTEMATIC NAME: 1-(5-nitro-1H-indol-3-yl)ethanone
MOLECULAR FORMULA: C10H8N2O3
MOLECULAR WEIGHT: 204.18212
SMILES: CC(=O)C1=CNC2=C1C=C(C=C2)[N+](=O)[O-]
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Product OPENEYE NAME: 1-benzyl-2-(2,2-diphenyl-1,3-dioxolan-4-yl)piperidine
CAS Name: 2-(2,2-diphenyl-1,3-dioxolan-4-yl)-1-(phenylmethyl)piperidine
IUPAC NAME: 1-benzyl-2-(2,2-diphenyl-1,3-dioxolan-4-yl)piperidine
SYSTEMATIC NAME: 2-(2,2-diphenyl-1,3-dioxolan-4-yl)-1-(phenylmethyl)piperidine
MOLECULAR FORMULA: C27H29NO2
MOLECULAR WEIGHT: 399.52466
SMILES: C1CCN(C(C1)C2COC(O2)(C3=CC=CC=C3)C4=CC=CC=C4)CC5=CC=CC=C5
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Product OPENEYE NAME: 3-chloro-2-nitro-benzoic acid
CAS Name: 3-chloro-2-nitrobenzoic acid
IUPAC NAME: 3-chloro-2-nitrobenzoic acid
SYSTEMATIC NAME: 3-chloranyl-2-nitro-benzoic acid
MOLECULAR FORMULA: C7H4ClNO4
MOLECULAR WEIGHT: 201.56396
SMILES: C1=CC(=C(C(=C1)Cl)[N+](=O)[O-])C(=O)O
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Product OPENEYE NAME: cyclohex-3-ene-1-carboxylic acid
CAS Name: 1-cyclohex-3-enecarboxylic acid
IUPAC NAME: cyclohex-3-ene-1-carboxylic acid
SYSTEMATIC NAME: cyclohex-3-ene-1-carboxylic acid
MOLECULAR FORMULA: C7H10O2
MOLECULAR WEIGHT: 126.1531
SMILES: C1CC(CC=C1)C(=O)O
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Product OPENEYE NAME: 1-diethylphosphoryloxyethane
CAS Name: 1-diethylphosphoryloxyethane
IUPAC NAME: 1-diethylphosphoryloxyethane
SYSTEMATIC NAME: 1-diethylphosphoryloxyethane
MOLECULAR FORMULA: C6H15O2P
MOLECULAR WEIGHT: 150.155861
SMILES: CCOP(=O)(CC)CC
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Product OPENEYE NAME: 6-methylpiperidin-2-one
CAS Name: 6-methyl-2-piperidinone
IUPAC NAME: 6-methylpiperidin-2-one
SYSTEMATIC NAME: 6-methylpiperidin-2-one
MOLECULAR FORMULA: C6H11NO
MOLECULAR WEIGHT: 113.15764
SMILES: CC1CCCC(=O)N1
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Product OPENEYE NAME: 3,5-dibromo-2-hydroxy-N-[3-(trifluoromethyl)phenyl]benzamide
CAS Name: 3,5-dibromo-2-hydroxy-N-[3-(trifluoromethyl)phenyl]benzamide
IUPAC NAME: 3,5-dibromo-2-hydroxy-N-[3-(trifluoromethyl)phenyl]benzamide
SYSTEMATIC NAME: 3,5-bis(bromanyl)-2-oxidanyl-N-[3-(trifluoromethyl)phenyl]benzamide
MOLECULAR FORMULA: C14H8Br2F3NO2
MOLECULAR WEIGHT: 439.02203
SMILES: C1=CC(=CC(=C1)NC(=O)C2=CC(=CC(=C2O)Br)Br)C(F)(F)F
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Product OPENEYE NAME: [2-hydroxy-2-(3-hydroxyphenyl)ethyl]ammonium chloride
CAS Name: [2-hydroxy-2-(3-hydroxyphenyl)ethyl]ammonium chloride
IUPAC NAME: [2-hydroxy-2-(3-hydroxyphenyl)ethyl]azanium chloride
SYSTEMATIC NAME: [2-(3-hydroxyphenyl)-2-oxidanyl-ethyl]azanium chloride
MOLECULAR FORMULA: C8H12ClNO2
MOLECULAR WEIGHT: 189.63938
SMILES: C1=CC(=CC(=C1)O)C(C[NH3+])O.[Cl-]
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