Product OPENEYE NAME: 1,2,3,5-tetrachloro-4-nitro-benzene
CAS Name: 1,2,3,5-tetrachloro-4-nitrobenzene
IUPAC NAME: 1,2,3,5-tetrachloro-4-nitrobenzene
SYSTEMATIC NAME: 1,2,3,5-tetrakis(chloranyl)-4-nitro-benzene
MOLECULAR FORMULA: C6HCl4NO2
MOLECULAR WEIGHT: 260.88964
SMILES: C1=C(C(=C(C(=C1Cl)Cl)Cl)[N+](=O)[O-])Cl
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Product OPENEYE NAME: aziridine-1-carboxamide
CAS Name: 1-aziridinecarboxamide
IUPAC NAME: aziridine-1-carboxamide
SYSTEMATIC NAME: aziridine-1-carboxamide
MOLECULAR FORMULA: C3H6N2O
MOLECULAR WEIGHT: 86.09254
SMILES: C1CN1C(=O)N
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Product OPENEYE NAME: N,N-dimethylaziridine-1-carboxamide
CAS Name: N,N-dimethyl-1-aziridinecarboxamide
IUPAC NAME: N,N-dimethylaziridine-1-carboxamide
SYSTEMATIC NAME: N,N-dimethylaziridine-1-carboxamide
MOLECULAR FORMULA: C5H10N2O
MOLECULAR WEIGHT: 114.1457
SMILES: CN(C)C(=O)N1CC1
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Product OPENEYE NAME: N-isopropylaziridine-1-carboxamide
CAS Name: N-propan-2-yl-1-aziridinecarboxamide
IUPAC NAME: N-propan-2-ylaziridine-1-carboxamide
SYSTEMATIC NAME: N-propan-2-ylaziridine-1-carboxamide
MOLECULAR FORMULA: C6H12N2O
MOLECULAR WEIGHT: 128.17228
SMILES: CC(C)NC(=O)N1CC1
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Product OPENEYE NAME: 4,5-dihydro-1H-imidazol-2-yl(tetralin-5-yl)ammonium chloride
CAS Name: 4,5-dihydro-1H-imidazol-2-yl(5,6,7,8-tetrahydronaphthalen-1-yl)ammonium chloride
IUPAC NAME: 4,5-dihydro-1H-imidazol-2-yl(5,6,7,8-tetrahydronaphthalen-1-yl)azanium chloride
SYSTEMATIC NAME: 4,5-dihydro-1H-imidazol-2-yl(5,6,7,8-tetrahydronaphthalen-1-yl)azanium chloride
MOLECULAR FORMULA: C13H18ClN3
MOLECULAR WEIGHT: 251.75512
SMILES: C1CCC2=C(C1)C=CC=C2[NH2+]C3=NCCN3.[Cl-]
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Product OPENEYE NAME: cyclobutene-1,2-dicarbonitrile
CAS Name: cyclobutene-1,2-dicarbonitrile
IUPAC NAME: cyclobutene-1,2-dicarbonitrile
SYSTEMATIC NAME: cyclobutene-1,2-dicarbonitrile
MOLECULAR FORMULA: C6H4N2
MOLECULAR WEIGHT: 104.10936
SMILES: C1CC(=C1C#N)C#N
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Product OPENEYE NAME: 4-methylbenzaldehyde oxime
CAS Name: 4-methylbenzaldehyde oxime
IUPAC NAME: N-[(4-methylphenyl)methylidene]hydroxylamine
SYSTEMATIC NAME: N-[(4-methylphenyl)methylidene]hydroxylamine
MOLECULAR FORMULA: C8H9NO
MOLECULAR WEIGHT: 135.16316
SMILES: CC1=CC=C(C=C1)C=NO
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Product OPENEYE NAME: N-methyladamantan-1-amine
CAS Name: N-methyl-1-adamantanamine
IUPAC NAME: N-methyladamantan-1-amine
SYSTEMATIC NAME: N-methyladamantan-1-amine
MOLECULAR FORMULA: C11H19N
MOLECULAR WEIGHT: 165.27526
SMILES: CNC12CC3CC(C1)CC(C3)C2
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Product OPENEYE NAME: N-methyladamantan-1-amine hydrochloride
CAS Name: N-methyl-1-adamantanamine hydrochloride
IUPAC NAME: N-methyladamantan-1-amine hydrochloride
SYSTEMATIC NAME: N-methyladamantan-1-amine hydrochloride
MOLECULAR FORMULA: C11H20ClN
MOLECULAR WEIGHT: 201.7362
SMILES: CNC12CC3CC(C1)CC(C3)C2.Cl
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Product OPENEYE NAME: N,N-dimethyladamantan-1-amine
CAS Name: N,N-dimethyl-1-adamantanamine
IUPAC NAME: N,N-dimethyladamantan-1-amine
SYSTEMATIC NAME: N,N-dimethyladamantan-1-amine
MOLECULAR FORMULA: C12H21N
MOLECULAR WEIGHT: 179.30184
SMILES: CN(C)C12CC3CC(C1)CC(C3)C2
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Product OPENEYE NAME: N-ethyladamantan-1-amine hydrochloride
CAS Name: N-ethyl-1-adamantanamine hydrochloride
IUPAC NAME: N-ethyladamantan-1-amine hydrochloride
SYSTEMATIC NAME: N-ethyladamantan-1-amine hydrochloride
MOLECULAR FORMULA: C12H22ClN
MOLECULAR WEIGHT: 215.76278
SMILES: CCNC12CC3CC(C1)CC(C3)C2.Cl
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Product OPENEYE NAME: N-ethyladamantan-1-amine
CAS Name: N-ethyl-1-adamantanamine
IUPAC NAME: N-ethyladamantan-1-amine
SYSTEMATIC NAME: N-ethyladamantan-1-amine
MOLECULAR FORMULA: C12H21N
MOLECULAR WEIGHT: 179.30184
SMILES: CCNC12CC3CC(C1)CC(C3)C2
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Product OPENEYE NAME: N-propyladamantan-1-amine hydrochloride
CAS Name: N-propyl-1-adamantanamine hydrochloride
IUPAC NAME: N-propyladamantan-1-amine hydrochloride
SYSTEMATIC NAME: N-propyladamantan-1-amine hydrochloride
MOLECULAR FORMULA: C13H24ClN
MOLECULAR WEIGHT: 229.78936
SMILES: CCCNC12CC3CC(C1)CC(C3)C2.Cl
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Product OPENEYE NAME: N-propyladamantan-1-amine
CAS Name: N-propyl-1-adamantanamine
IUPAC NAME: N-propyladamantan-1-amine
SYSTEMATIC NAME: N-propyladamantan-1-amine
MOLECULAR FORMULA: C13H23N
MOLECULAR WEIGHT: 193.32842
SMILES: CCCNC12CC3CC(C1)CC(C3)C2
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Product OPENEYE NAME: 2-piperidin-1-ium-4-ylethyl 3-methyl-4-oxo-2-phenyl-chromene-8-carboxylate chloride
CAS Name: 3-methyl-4-oxo-2-phenyl-1-benzopyran-8-carboxylic acid 2-(4-piperidin-1-iumyl)ethyl ester chloride
IUPAC NAME: 2-piperidin-1-ium-4-ylethyl 3-methyl-4-oxo-2-phenylchromene-8-carboxylate chloride
SYSTEMATIC NAME: 2-piperidin-1-ium-4-ylethyl 3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxylate chloride
MOLECULAR FORMULA: C24H26ClNO4
MOLECULAR WEIGHT: 427.92054
SMILES: CC1=C(OC2=C(C1=O)C=CC=C2C(=O)OCCC3CC[NH2+]CC3)C4=CC=CC=C4.[Cl-]
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Product OPENEYE NAME: 2-(4-piperidyl)ethyl 3-methyl-4-oxo-2-phenyl-chromene-8-carboxylate
CAS Name: 3-methyl-4-oxo-2-phenyl-1-benzopyran-8-carboxylic acid 2-(4-piperidinyl)ethyl ester
IUPAC NAME: 2-piperidin-4-ylethyl 3-methyl-4-oxo-2-phenylchromene-8-carboxylate
SYSTEMATIC NAME: 2-piperidin-4-ylethyl 3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxylate
MOLECULAR FORMULA: C24H25NO4
MOLECULAR WEIGHT: 391.4596
SMILES: CC1=C(OC2=C(C1=O)C=CC=C2C(=O)OCCC3CCNCC3)C4=CC=CC=C4
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Product OPENEYE NAME: 3,5-dimethyl-1-oxido-pyridin-1-ium
CAS Name: 3,5-dimethyl-1-oxidopyridin-1-ium
IUPAC NAME: 3,5-dimethyl-1-oxidopyridin-1-ium
SYSTEMATIC NAME: 3,5-dimethyl-1-oxidanidyl-pyridin-1-ium
MOLECULAR FORMULA: C7H9NO
MOLECULAR WEIGHT: 123.15246
SMILES: CC1=CC(=C[N+](=C1)[O-])C
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Product OPENEYE NAME: (5R,6S)-5,6-dihydronaphtho[1,2-b]phenanthrene-5,6-diol
CAS Name: (5R,6S)-5,6-dihydronaphtho[1,2-b]phenanthrene-5,6-diol
IUPAC NAME: (5R,6S)-5,6-dihydronaphtho[1,2-b]phenanthrene-5,6-diol
SYSTEMATIC NAME: (5R,6S)-5,6-dihydronaphtho[1,2-b]phenanthrene-5,6-diol
MOLECULAR FORMULA: C22H16O2
MOLECULAR WEIGHT: 312.36124
SMILES: C1=CC=C2C(=C1)C=CC3=CC4=C(C=C32)[C@@H]([C@@H](C5=CC=CC=C54)O)O
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Product OPENEYE NAME: (5R,6R)-5,6-dihydronaphtho[1,2-b]phenanthrene-5,6-diol
CAS Name: (5R,6R)-5,6-dihydronaphtho[1,2-b]phenanthrene-5,6-diol
IUPAC NAME: (5R,6R)-5,6-dihydronaphtho[1,2-b]phenanthrene-5,6-diol
SYSTEMATIC NAME: (5R,6R)-5,6-dihydronaphtho[1,2-b]phenanthrene-5,6-diol
MOLECULAR FORMULA: C22H16O2
MOLECULAR WEIGHT: 312.36124
SMILES: C1=CC=C2C(=C1)C=CC3=CC4=C(C=C32)[C@H]([C@@H](C5=CC=CC=C54)O)O
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Product OPENEYE NAME: 2-[(1R)-cyclohex-3-en-1-yl]-2-oxo-acetic acid
CAS Name: 2-[(1R)-1-cyclohex-3-enyl]-2-oxoacetic acid
IUPAC NAME: 2-[(1R)-cyclohex-3-en-1-yl]-2-oxoacetic acid
SYSTEMATIC NAME: 2-[(1R)-cyclohex-3-en-1-yl]-2-oxidanylidene-ethanoic acid
MOLECULAR FORMULA: C8H10O3
MOLECULAR WEIGHT: 154.1632
SMILES: C1C[C@H](CC=C1)C(=O)C(=O)O
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Product OPENEYE NAME: 3,6-dimethyltetrahydropyran-2-one
CAS Name: 3,6-dimethyl-2-oxanone
IUPAC NAME: 3,6-dimethyloxan-2-one
SYSTEMATIC NAME: 3,6-dimethyloxan-2-one
MOLECULAR FORMULA: C7H12O2
MOLECULAR WEIGHT: 128.16898
SMILES: CC1CCC(OC1=O)C
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Product OPENEYE NAME: ethyl 4-(dicyanomethylazo)benzoate
CAS Name: 4-(dicyanomethylazo)benzoic acid ethyl ester
IUPAC NAME: ethyl 4-(dicyanomethyldiazenyl)benzoate
SYSTEMATIC NAME: ethyl 4-(dicyanomethyldiazenyl)benzoate
MOLECULAR FORMULA: C12H10N4O2
MOLECULAR WEIGHT: 242.2334
SMILES: CCOC(=O)C1=CC=C(C=C1)N=NC(C#N)C#N
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Product OPENEYE NAME: 2-(3-chlorophenyl)azopropanedinitrile
CAS Name: 2-(3-chlorophenyl)azopropanedinitrile
IUPAC NAME: 2-[(3-chlorophenyl)diazenyl]propanedinitrile
SYSTEMATIC NAME: 2-[(3-chlorophenyl)diazenyl]propanedinitrile
MOLECULAR FORMULA: C9H5ClN4
MOLECULAR WEIGHT: 204.6158
SMILES: C1=CC(=CC(=C1)Cl)N=NC(C#N)C#N
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