Product OPENEYE NAME: 1-nitrosoimidazolidin-2-one
CAS Name: 1-nitroso-2-imidazolidinone
IUPAC NAME: 1-nitrosoimidazolidin-2-one
SYSTEMATIC NAME: 1-nitrosoimidazolidin-2-one
MOLECULAR FORMULA: C3H5N3O2
MOLECULAR WEIGHT: 115.0907
SMILES: C1CN(C(=O)N1)N=O
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Product OPENEYE NAME: 4-oxo-N-(4-sulfamoylphenyl)chromene-2-carboxamide
CAS Name: 4-oxo-N-(4-sulfamoylphenyl)-1-benzopyran-2-carboxamide
IUPAC NAME: 4-oxo-N-(4-sulfamoylphenyl)chromene-2-carboxamide
SYSTEMATIC NAME: 4-oxidanylidene-N-(4-sulfamoylphenyl)chromene-2-carboxamide
MOLECULAR FORMULA: C16H12N2O5S
MOLECULAR WEIGHT: 344.34188
SMILES: C1=CC=C2C(=C1)C(=O)C=C(O2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N
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Product OPENEYE NAME: 1-(3-chloro-4-methyl-phenyl)-4-[6-[4-(1,1-dimethylpropyl)phenoxy]hexyl]piperazine hydrochloride
CAS Name: 1-(3-chloro-4-methylphenyl)-4-[6-[4-(2-methylbutan-2-yl)phenoxy]hexyl]piperazine hydrochloride
IUPAC NAME: 1-(3-chloro-4-methylphenyl)-4-[6-[4-(2-methylbutan-2-yl)phenoxy]hexyl]piperazine hydrochloride
SYSTEMATIC NAME: 1-(3-chloranyl-4-methyl-phenyl)-4-[6-[4-(2-methylbutan-2-yl)phenoxy]hexyl]piperazine hydrochloride
MOLECULAR FORMULA: C28H42Cl2N2O
MOLECULAR WEIGHT: 493.55188
SMILES: CCC(C)(C)C1=CC=C(C=C1)OCCCCCCN2CCN(CC2)C3=CC(=C(C=C3)C)Cl.Cl
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Product OPENEYE NAME: 1-(3-chloro-4-methyl-phenyl)-4-[6-[4-(1,1-dimethylpropyl)phenoxy]hexyl]piperazine
CAS Name: 1-(3-chloro-4-methylphenyl)-4-[6-[4-(2-methylbutan-2-yl)phenoxy]hexyl]piperazine
IUPAC NAME: 1-(3-chloro-4-methylphenyl)-4-[6-[4-(2-methylbutan-2-yl)phenoxy]hexyl]piperazine
SYSTEMATIC NAME: 1-(3-chloranyl-4-methyl-phenyl)-4-[6-[4-(2-methylbutan-2-yl)phenoxy]hexyl]piperazine
MOLECULAR FORMULA: C28H41ClN2O
MOLECULAR WEIGHT: 457.09094
SMILES: CCC(C)(C)C1=CC=C(C=C1)OCCCCCCN2CCN(CC2)C3=CC(=C(C=C3)C)Cl
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Product OPENEYE NAME: 2,4-diethyl-6-methylsulfanyl-1,3,5-triazine
CAS Name: 2,4-diethyl-6-(methylthio)-1,3,5-triazine
IUPAC NAME: 2,4-diethyl-6-methylsulfanyl-1,3,5-triazine
SYSTEMATIC NAME: 2,4-diethyl-6-methylsulfanyl-1,3,5-triazine
MOLECULAR FORMULA: C8H13N3S
MOLECULAR WEIGHT: 183.27392
SMILES: CCC1=NC(=NC(=N1)SC)CC
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Product OPENEYE NAME: hexane-2,3-dione
CAS Name: hexane-2,3-dione
IUPAC NAME: hexane-2,3-dione
SYSTEMATIC NAME: hexane-2,3-dione
MOLECULAR FORMULA: C6H10O2
MOLECULAR WEIGHT: 114.1424
SMILES: CCCC(=O)C(=O)C
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Product OPENEYE NAME: N-diphenoxyphosphorylaniline
CAS Name: N-diphenoxyphosphorylaniline
IUPAC NAME: N-diphenoxyphosphorylaniline
SYSTEMATIC NAME: N-diphenoxyphosphorylaniline
MOLECULAR FORMULA: C18H16NO3P
MOLECULAR WEIGHT: 325.298301
SMILES: C1=CC=C(C=C1)NP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3
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Product OPENEYE NAME: 3,3-dimethylbutan-1-amine
CAS Name: 3,3-dimethyl-1-butanamine
IUPAC NAME: 3,3-dimethylbutan-1-amine
SYSTEMATIC NAME: 3,3-dimethylbutan-1-amine
MOLECULAR FORMULA: C6H15N
MOLECULAR WEIGHT: 101.19
SMILES: CC(C)(C)CCN
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Product OPENEYE NAME: methyl 3-methoxypropanoate
CAS Name: 3-methoxypropanoic acid methyl ester
IUPAC NAME: methyl 3-methoxypropanoate
SYSTEMATIC NAME: methyl 3-methoxypropanoate
MOLECULAR FORMULA: C5H10O3
MOLECULAR WEIGHT: 118.1311
SMILES: COCCC(=O)OC
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Product OPENEYE NAME: 7-(dimethylamino)-6,6-dimethyl-nonan-3-one
CAS Name: 7-(dimethylamino)-6,6-dimethyl-3-nonanone
IUPAC NAME: 7-(dimethylamino)-6,6-dimethylnonan-3-one
SYSTEMATIC NAME: 7-(dimethylamino)-6,6-dimethyl-nonan-3-one
MOLECULAR FORMULA: C13H27NO
MOLECULAR WEIGHT: 213.35958
SMILES: CCC(C(C)(C)CCC(=O)CC)N(C)C
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Product OPENEYE NAME: 2-(dimethoxyphosphinothioylsulfanylmethylsulfanyl)ethyl carbamate
CAS Name: carbamic acid 2-[(dimethoxyphosphinothioylthio)methylthio]ethyl ester
IUPAC NAME: 2-(dimethoxyphosphinothioylsulfanylmethylsulfanyl)ethyl carbamate
SYSTEMATIC NAME: 2-(dimethoxyphosphinothioylsulfanylmethylsulfanyl)ethyl carbamate
MOLECULAR FORMULA: C6H14NO4PS3
MOLECULAR WEIGHT: 291.348421
SMILES: COP(=S)(OC)SCSCCOC(=O)N
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Product OPENEYE NAME: 2-[[isopropoxy(methoxy)phosphinothioyl]sulfanylmethylsulfanyl]ethyl N-ethylcarbamate
CAS Name: N-ethylcarbamic acid 2-[[[methoxy(propan-2-yloxy)phosphinothioyl]thio]methylthio]ethyl ester
IUPAC NAME: 2-[[methoxy(propan-2-yloxy)phosphinothioyl]sulfanylmethylsulfanyl]ethyl N-ethylcarbamate
SYSTEMATIC NAME: 2-[[methoxy(propan-2-yloxy)phosphinothioyl]sulfanylmethylsulfanyl]ethyl N-ethylcarbamate
MOLECULAR FORMULA: C10H22NO4PS3
MOLECULAR WEIGHT: 347.454741
SMILES: CCNC(=O)OCCSCSP(=S)(OC)OC(C)C
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Product OPENEYE NAME: trimethyl-[4-(2-oxopyrrolidin-1-yl)but-3-ynyl]ammonium iodide
CAS Name: trimethyl-[4-(2-oxo-1-pyrrolidinyl)but-3-ynyl]ammonium iodide
IUPAC NAME: trimethyl-[4-(2-oxopyrrolidin-1-yl)but-3-ynyl]azanium iodide
SYSTEMATIC NAME: trimethyl-[4-(2-oxidanylidenepyrrolidin-1-yl)but-3-ynyl]azanium iodide
MOLECULAR FORMULA: C11H19IN2O
MOLECULAR WEIGHT: 322.18583
SMILES: C[N+](C)(C)CCC#CN1CCCC1=O.[I-]
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Product OPENEYE NAME: trimethyl-[4-(2-oxopyrrolidin-1-yl)but-3-ynyl]ammonium
CAS Name: trimethyl-[4-(2-oxo-1-pyrrolidinyl)but-3-ynyl]ammonium
IUPAC NAME: trimethyl-[4-(2-oxopyrrolidin-1-yl)but-3-ynyl]azanium
SYSTEMATIC NAME: trimethyl-[4-(2-oxidanylidenepyrrolidin-1-yl)but-3-ynyl]azanium
MOLECULAR FORMULA: C11H19N2O+
MOLECULAR WEIGHT: 195.28136
SMILES: C[N+](C)(C)CCC#CN1CCCC1=O
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Product OPENEYE NAME: N-methyl-N-(4-pyrrolidin-1-ylbut-2-ynyl)acetamide
CAS Name: N-methyl-N-[4-(1-pyrrolidinyl)but-2-ynyl]acetamide
IUPAC NAME: N-methyl-N-(4-pyrrolidin-1-ylbut-2-ynyl)acetamide
SYSTEMATIC NAME: N-methyl-N-(4-pyrrolidin-1-ylbut-2-ynyl)ethanamide
MOLECULAR FORMULA: C11H18N2O
MOLECULAR WEIGHT: 194.27342
SMILES: CC(=O)N(C)CC#CCN1CCCC1
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Product OPENEYE NAME: N-[4-(dimethylamino)but-2-ynyl]-N-methyl-acetamide; oxalic acid
CAS Name: N-[4-(dimethylamino)but-2-ynyl]-N-methylacetamide; oxalic acid
IUPAC NAME: N-[4-(dimethylamino)but-2-ynyl]-N-methylacetamide; oxalic acid
SYSTEMATIC NAME: N-[4-(dimethylamino)but-2-ynyl]-N-methyl-ethanamide; ethanedioic acid
MOLECULAR FORMULA: C11H18N2O5
MOLECULAR WEIGHT: 258.27102
SMILES: CC(=O)N(C)CC#CCN(C)C.C(=O)(C(=O)O)O
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Product OPENEYE NAME: N-[4-(dimethylamino)but-2-ynyl]-N-methyl-acetamide
CAS Name: N-[4-(dimethylamino)but-2-ynyl]-N-methylacetamide
IUPAC NAME: N-[4-(dimethylamino)but-2-ynyl]-N-methylacetamide
SYSTEMATIC NAME: N-[4-(dimethylamino)but-2-ynyl]-N-methyl-ethanamide
MOLECULAR FORMULA: C9H16N2O
MOLECULAR WEIGHT: 168.23614
SMILES: CC(=O)N(C)CC#CCN(C)C
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