Product OPENEYE NAME: 5,5-diethyl-1,3-oxazinane-2,4-dione
CAS Name: 5,5-diethyl-1,3-oxazinane-2,4-dione
IUPAC NAME: 5,5-diethyl-1,3-oxazinane-2,4-dione
SYSTEMATIC NAME: 5,5-diethyl-1,3-oxazinane-2,4-dione
MOLECULAR FORMULA: C8H13NO3
MOLECULAR WEIGHT: 171.19372
SMILES: CCC1(COC(=O)NC1=O)CC
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Product OPENEYE NAME: 2,4-diazaspiro[4.5]decane-1,3-dione
CAS Name: 2,4-diazaspiro[4.5]decane-1,3-dione
IUPAC NAME: 2,4-diazaspiro[4.5]decane-1,3-dione
SYSTEMATIC NAME: 2,4-diazaspiro[4.5]decane-1,3-dione
MOLECULAR FORMULA: C8H12N2O2
MOLECULAR WEIGHT: 168.19308
SMILES: C1CCC2(CC1)C(=O)NC(=O)N2
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Product OPENEYE NAME: 1,3-dimethyladamantane
CAS Name: 1,3-dimethyladamantane
IUPAC NAME: 1,3-dimethyladamantane
SYSTEMATIC NAME: 1,3-dimethyladamantane
MOLECULAR FORMULA: C12H20
MOLECULAR WEIGHT: 164.2872
SMILES: CC12CC3CC(C1)CC(C3)(C2)C
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Product OPENEYE NAME: isochromane-1,3-dione
CAS Name: 3,4-dihydro-1H-2-benzopyran-1,3-dione
IUPAC NAME: 4H-isochromene-1,3-dione
SYSTEMATIC NAME: 4H-isochromene-1,3-dione
MOLECULAR FORMULA: C9H6O3
MOLECULAR WEIGHT: 162.14214
SMILES: C1C2=CC=CC=C2C(=O)OC1=O
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Product OPENEYE NAME: 1-(1H-indol-3-yl)ethanone
CAS Name: 1-(1H-indol-3-yl)ethanone
IUPAC NAME: 1-(1H-indol-3-yl)ethanone
SYSTEMATIC NAME: 1-(1H-indol-3-yl)ethanone
MOLECULAR FORMULA: C10H9NO
MOLECULAR WEIGHT: 159.18456
SMILES: CC(=O)C1=CNC2=CC=CC=C21
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Product OPENEYE NAME: N1,N1,N2,N2-tetramethylbenzene-1,2-diamine
CAS Name: N1,N1,N2,N2-tetramethylbenzene-1,2-diamine
IUPAC NAME: 1-N,1-N,2-N,2-N-tetramethylbenzene-1,2-diamine
SYSTEMATIC NAME: N1,N1,N2,N2-tetramethylbenzene-1,2-diamine
MOLECULAR FORMULA: C10H16N2
MOLECULAR WEIGHT: 164.24744
SMILES: CN(C)C1=CC=CC=C1N(C)C
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Product OPENEYE NAME: 5-(4-pyridyl)-1,3,4-oxadiazol-2-amine
CAS Name: 5-pyridin-4-yl-1,3,4-oxadiazol-2-amine
IUPAC NAME: 5-pyridin-4-yl-1,3,4-oxadiazol-2-amine
SYSTEMATIC NAME: 5-pyridin-4-yl-1,3,4-oxadiazol-2-amine
MOLECULAR FORMULA: C7H6N4O
MOLECULAR WEIGHT: 162.14874
SMILES: C1=CN=CC=C1C2=NN=C(O2)N
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Product OPENEYE NAME: 2-[(2-fluorophenyl)methyl]guanidine
CAS Name: 2-[(2-fluorophenyl)methyl]guanidine
IUPAC NAME: 2-[(2-fluorophenyl)methyl]guanidine
SYSTEMATIC NAME: 2-[(2-fluorophenyl)methyl]guanidine
MOLECULAR FORMULA: C8H10FN3
MOLECULAR WEIGHT: 167.183503
SMILES: C1=CC=C(C(=C1)CN=C(N)N)F
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Product OPENEYE NAME: 6-(trifluoromethyl)-1,3,5-triazine-2,4-diamine
CAS Name: 6-(trifluoromethyl)-1,3,5-triazine-2,4-diamine
IUPAC NAME: 6-(trifluoromethyl)-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: 6-(trifluoromethyl)-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C4H4F3N5
MOLECULAR WEIGHT: 179.10327
SMILES: C1(=NC(=NC(=N1)N)N)C(F)(F)F
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Product OPENEYE NAME: 2-nitroprop-1-enylbenzene
CAS Name: 2-nitroprop-1-enylbenzene
IUPAC NAME: 2-nitroprop-1-enylbenzene
SYSTEMATIC NAME: 2-nitroprop-1-enylbenzene
MOLECULAR FORMULA: C9H9NO2
MOLECULAR WEIGHT: 163.17326
SMILES: CC(=CC1=CC=CC=C1)[N+](=O)[O-]
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Product OPENEYE NAME: 2-ethyl-4,6-dimethoxy-1,3,5-triazine
CAS Name: 2-ethyl-4,6-dimethoxy-1,3,5-triazine
IUPAC NAME: 2-ethyl-4,6-dimethoxy-1,3,5-triazine
SYSTEMATIC NAME: 2-ethyl-4,6-dimethoxy-1,3,5-triazine
MOLECULAR FORMULA: C7H11N3O2
MOLECULAR WEIGHT: 169.18114
SMILES: CCC1=NC(=NC(=N1)OC)OC
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Product OPENEYE NAME: 6-pentyltetrahydropyran-2-one
CAS Name: 6-pentyl-2-oxanone
IUPAC NAME: 6-pentyloxan-2-one
SYSTEMATIC NAME: 6-pentyloxan-2-one
MOLECULAR FORMULA: C10H18O2
MOLECULAR WEIGHT: 170.24872
SMILES: CCCCCC1CCCC(=O)O1
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Product OPENEYE NAME: 3-oxo-N-thiazol-2-yl-butanamide
CAS Name: 3-oxo-N-(2-thiazolyl)butanamide
IUPAC NAME: 3-oxo-N-(1,3-thiazol-2-yl)butanamide
SYSTEMATIC NAME: 3-oxidanylidene-N-(1,3-thiazol-2-yl)butanamide
MOLECULAR FORMULA: C7H8N2O2S
MOLECULAR WEIGHT: 184.21562
SMILES: CC(=O)CC(=O)NC1=NC=CS1
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Product OPENEYE NAME: 2-benzyloxyguanidine
CAS Name: 2-phenylmethoxyguanidine
IUPAC NAME: 2-phenylmethoxyguanidine
SYSTEMATIC NAME: 2-phenylmethoxyguanidine
MOLECULAR FORMULA: C8H11N3O
MOLECULAR WEIGHT: 165.19244
SMILES: C1=CC=C(C=C1)CON=C(N)N
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Product OPENEYE NAME: 5-hexyltetrahydrofuran-2-one
CAS Name: 5-hexyl-2-oxolanone
IUPAC NAME: 5-hexyloxolan-2-one
SYSTEMATIC NAME: 5-hexyloxolan-2-one
MOLECULAR FORMULA: C10H18O2
MOLECULAR WEIGHT: 170.24872
SMILES: CCCCCCC1CCC(=O)O1
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Product OPENEYE NAME: 1,2,3,3,4,4,5,5-octachlorocyclopentene
CAS Name: 1,2,3,3,4,4,5,5-octachlorocyclopentene
IUPAC NAME: 1,2,3,3,4,4,5,5-octachlorocyclopentene
SYSTEMATIC NAME: 1,2,3,3,4,4,5,5-octakis(chloranyl)cyclopentene
MOLECULAR FORMULA: C5Cl8
MOLECULAR WEIGHT: 343.6775
SMILES: C1(=C(C(C(C1(Cl)Cl)(Cl)Cl)(Cl)Cl)Cl)Cl
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Product OPENEYE NAME: 1,2-dichloro-3,3,4,4,5,5-hexafluoro-cyclopentene
CAS Name: 1,2-dichloro-3,3,4,4,5,5-hexafluorocyclopentene
IUPAC NAME: 1,2-dichloro-3,3,4,4,5,5-hexafluorocyclopentene
SYSTEMATIC NAME: 1,2-bis(chloranyl)-3,3,4,4,5,5-hexakis(fluoranyl)cyclopentene
MOLECULAR FORMULA: C5Cl2F6
MOLECULAR WEIGHT: 244.949919
SMILES: C1(=C(C(C(C1(F)F)(F)F)(F)F)Cl)Cl
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Product OPENEYE NAME: 2-methyl-2,4-diazaspiro[4.5]decane-1,3-dione
CAS Name: 2-methyl-2,4-diazaspiro[4.5]decane-1,3-dione
IUPAC NAME: 2-methyl-2,4-diazaspiro[4.5]decane-1,3-dione
SYSTEMATIC NAME: 2-methyl-2,4-diazaspiro[4.5]decane-1,3-dione
MOLECULAR FORMULA: C9H14N2O2
MOLECULAR WEIGHT: 182.21966
SMILES: CN1C(=O)C2(CCCCC2)NC1=O
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Product OPENEYE NAME: 8-methyl-2,4-diazaspiro[4.5]decane-1,3-dione
CAS Name: 8-methyl-2,4-diazaspiro[4.5]decane-1,3-dione
IUPAC NAME: 8-methyl-2,4-diazaspiro[4.5]decane-1,3-dione
SYSTEMATIC NAME: 8-methyl-2,4-diazaspiro[4.5]decane-1,3-dione
MOLECULAR FORMULA: C9H14N2O2
MOLECULAR WEIGHT: 182.21966
SMILES: CC1CCC2(CC1)C(=O)NC(=O)N2
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Product OPENEYE NAME: 4-bromo-N,N-dimethyl-benzenesulfonamide
CAS Name: 4-bromo-N,N-dimethylbenzenesulfonamide
IUPAC NAME: 4-bromo-N,N-dimethylbenzenesulfonamide
SYSTEMATIC NAME: 4-bromanyl-N,N-dimethyl-benzenesulfonamide
MOLECULAR FORMULA: C8H10BrNO2S
MOLECULAR WEIGHT: 264.1395
SMILES: CN(C)S(=O)(=O)C1=CC=C(C=C1)Br
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Product OPENEYE NAME: 2-hydroxynaphthalene-1-carbaldehyde
CAS Name: 2-hydroxy-1-naphthalenecarboxaldehyde
IUPAC NAME: 2-hydroxynaphthalene-1-carbaldehyde
SYSTEMATIC NAME: 2-oxidanylnaphthalene-1-carbaldehyde
MOLECULAR FORMULA: C11H8O2
MOLECULAR WEIGHT: 172.18002
SMILES: C1=CC=C2C(=C1)C=CC(=C2C=O)O
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Product OPENEYE NAME: 1-(2,3-dihydroxy-4-methoxy-phenyl)ethanone
CAS Name: 1-(2,3-dihydroxy-4-methoxyphenyl)ethanone
IUPAC NAME: 1-(2,3-dihydroxy-4-methoxyphenyl)ethanone
SYSTEMATIC NAME: 1-[4-methoxy-2,3-bis(oxidanyl)phenyl]ethanone
MOLECULAR FORMULA: C9H10O4
MOLECULAR WEIGHT: 182.1733
SMILES: CC(=O)C1=C(C(=C(C=C1)OC)O)O
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Product OPENEYE NAME: 3-acetylbenzenesulfonyl fluoride
CAS Name: 3-acetylbenzenesulfonyl fluoride
IUPAC NAME: 3-acetylbenzenesulfonyl fluoride
SYSTEMATIC NAME: 3-ethanoylbenzenesulfonyl fluoride
MOLECULAR FORMULA: C8H7FO3S
MOLECULAR WEIGHT: 202.202783
SMILES: CC(=O)C1=CC(=CC=C1)S(=O)(=O)F
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