Product OPENEYE NAME: 1-methoxy-7H-benzo[a]anthracen-12-one
CAS Name: 1-methoxy-7H-benzo[a]anthracen-12-one
IUPAC NAME: 1-methoxy-7H-benzo[a]anthracen-12-one
SYSTEMATIC NAME: 1-methoxy-7H-benzo[a]anthracen-12-one
MOLECULAR FORMULA: C19H14O2
MOLECULAR WEIGHT: 274.31326
SMILES: COC1=CC=CC2=C1C3=C(CC4=CC=CC=C4C3=O)C=C2
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Product OPENEYE NAME: 3-methyl-7H-benzo[a]anthracen-12-one
CAS Name: 3-methyl-7H-benzo[a]anthracen-12-one
IUPAC NAME: 3-methyl-7H-benzo[a]anthracen-12-one
SYSTEMATIC NAME: 3-methyl-7H-benzo[a]anthracen-12-one
MOLECULAR FORMULA: C19H14O
MOLECULAR WEIGHT: 258.31386
SMILES: CC1=CC2=C(C=C1)C3=C(CC4=CC=CC=C4C3=O)C=C2
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Product OPENEYE NAME: 1,3-dioxolane; N-isopropylbicyclo[2.2.0]hexa-1(4),2,5-trien-3-amine
CAS Name: 1,3-dioxolane; N-propan-2-yl-3-bicyclo[2.2.0]hexa-1(4),2,5-trienamine
IUPAC NAME: 1,3-dioxolane; N-propan-2-ylbicyclo[2.2.0]hexa-1(4),2,5-trien-3-amine
SYSTEMATIC NAME: 1,3-dioxolane; N-propan-2-ylbicyclo[2.2.0]hexa-1(4),2,5-trien-3-amine
MOLECULAR FORMULA: C12H17NO2
MOLECULAR WEIGHT: 207.26888
SMILES: CC(C)NC1=CC2=C1C=C2.C1COCO1
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Product OPENEYE NAME: N-isopropylbicyclo[2.2.0]hexa-1,3,5-trien-3-amine
CAS Name: N-propan-2-yl-3-bicyclo[2.2.0]hexa-1,3,5-trienamine
IUPAC NAME: N-propan-2-ylbicyclo[2.2.0]hexa-1,3,5-trien-3-amine
SYSTEMATIC NAME: N-propan-2-ylbicyclo[2.2.0]hexa-1,3,5-trien-3-amine
MOLECULAR FORMULA: C9H11N
MOLECULAR WEIGHT: 133.19034
SMILES: CC(C)NC1=C2C=CC2=C1
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Product OPENEYE NAME: N,N-dimethylbicyclo[2.2.0]hexa-1(4),2,5-trien-3-amine; 1,3-dioxolane
CAS Name: N,N-dimethyl-3-bicyclo[2.2.0]hexa-1(4),2,5-trienamine; 1,3-dioxolane
IUPAC NAME: N,N-dimethylbicyclo[2.2.0]hexa-1(4),2,5-trien-3-amine; 1,3-dioxolane
SYSTEMATIC NAME: N,N-dimethylbicyclo[2.2.0]hexa-1(4),2,5-trien-3-amine; 1,3-dioxolane
MOLECULAR FORMULA: C11H15NO2
MOLECULAR WEIGHT: 193.2423
SMILES: CN(C)C1=CC2=C1C=C2.C1COCO1
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Product OPENEYE NAME: N,N-dimethylbicyclo[2.2.0]hexa-1(4),2,5-trien-3-amine
CAS Name: N,N-dimethyl-3-bicyclo[2.2.0]hexa-1(4),2,5-trienamine
IUPAC NAME: N,N-dimethylbicyclo[2.2.0]hexa-1(4),2,5-trien-3-amine
SYSTEMATIC NAME: N,N-dimethylbicyclo[2.2.0]hexa-1(4),2,5-trien-3-amine
MOLECULAR FORMULA: C8H9N
MOLECULAR WEIGHT: 119.16376
SMILES: CN(C)C1=CC2=C1C=C2
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C10H13BrO2S
MOLECULAR WEIGHT: 277.17802
SMILES: C[S+](=O)(C)CC(=O)C1=CC=CC=C1.[Br-]
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Product OPENEYE NAME: 2-[4-[1-[4-(2-carboxycyclohexanecarbonyl)oxycyclohexyl]-1-methyl-ethyl]cyclohexoxy]carbonylcyclohexanecarboxylic acid
CAS Name: 2-[[4-[2-[4-[(2-carboxycyclohexyl)-oxomethoxy]cyclohexyl]propan-2-yl]cyclohexyl]oxy-oxomethyl]-1-cyclohexanecarboxylic acid
IUPAC NAME: 2-[4-[2-[4-(2-carboxycyclohexanecarbonyl)oxycyclohexyl]propan-2-yl]cyclohexyl]oxycarbonylcyclohexane-1-carboxylic acid
SYSTEMATIC NAME: 2-[4-[2-[4-(2-carboxycyclohexyl)carbonyloxycyclohexyl]propan-2-yl]cyclohexyl]oxycarbonylcyclohexane-1-carboxylic acid
MOLECULAR FORMULA: C31H48O8
MOLECULAR WEIGHT: 548.70802
SMILES: CC(C)(C1CCC(CC1)OC(=O)C2CCCCC2C(=O)O)C3CCC(CC3)OC(=O)C4CCCCC4C(=O)O
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Product OPENEYE NAME: 1,2,3,4,7,7-hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid
CAS Name: 1,2,3,4,7,7-hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid
IUPAC NAME: 1,2,3,4,7,7-hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid
SYSTEMATIC NAME: 1,2,3,4,7,7-hexakis(chloranyl)bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid
MOLECULAR FORMULA: C9H4Cl6O4
MOLECULAR WEIGHT: 388.84366
SMILES: C1=CC2(C(C(C1(C2(Cl)Cl)Cl)(C(=O)O)Cl)(C(=O)O)Cl)Cl
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Product OPENEYE NAME: (4-benzoyl-3-methylsulfonyloxy-phenyl) methanesulfonate
CAS Name: methanesulfonic acid (4-benzoyl-3-methylsulfonyloxyphenyl) ester
IUPAC NAME: (4-benzoyl-3-methylsulfonyloxyphenyl) methanesulfonate
SYSTEMATIC NAME: [3-methylsulfonyloxy-4-(phenylcarbonyl)phenyl] methanesulfonate
MOLECULAR FORMULA: C15H14O7S2
MOLECULAR WEIGHT: 370.39746
SMILES: CS(=O)(=O)OC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)OS(=O)(=O)C
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Product OPENEYE NAME: bis(4-nitrophenyl)iodonium chloride
CAS Name: bis(4-nitrophenyl)iodonium chloride
IUPAC NAME: bis(4-nitrophenyl)iodanium chloride
SYSTEMATIC NAME: bis(4-nitrophenyl)iodanium chloride
MOLECULAR FORMULA: C12H8ClIN2O4
MOLECULAR WEIGHT: 406.56039
SMILES: C1=CC(=CC=C1[N+](=O)[O-])[I+]C2=CC=C(C=C2)[N+](=O)[O-].[Cl-]
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C10H13ClO2S
MOLECULAR WEIGHT: 232.72702
SMILES: C[S+](=O)(C)CC(=O)C1=CC=CC=C1.[Cl-]
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Product OPENEYE NAME: 1-(4-nitrophenyl)-2-tetrahydrothiophen-1-ium-1-yl-ethanone chloride
CAS Name: 1-(4-nitrophenyl)-2-(1-thiolan-1-iumyl)ethanone chloride
IUPAC NAME: 1-(4-nitrophenyl)-2-(thiolan-1-ium-1-yl)ethanone chloride
SYSTEMATIC NAME: 1-(4-nitrophenyl)-2-(thiolan-1-ium-1-yl)ethanone chloride
MOLECULAR FORMULA: C12H14ClNO3S
MOLECULAR WEIGHT: 287.76246
SMILES: C1CC[S+](C1)CC(=O)C2=CC=C(C=C2)[N+](=O)[O-].[Cl-]
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Product OPENEYE NAME: (2-benzoylphenyl)methanesulfonate
CAS Name: (2-benzoylphenyl)methanesulfonate
IUPAC NAME: (2-benzoylphenyl)methanesulfonate
SYSTEMATIC NAME: [2-(phenylcarbonyl)phenyl]methanesulfonate
MOLECULAR FORMULA: C14H11O4S-
MOLECULAR WEIGHT: 275.29974
SMILES: C1=CC=C(C=C1)C(=O)C2=CC=CC=C2CS(=O)(=O)[O-]
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Product OPENEYE NAME: (2-benzoylphenyl)methanesulfonic acid
CAS Name: (2-benzoylphenyl)methanesulfonic acid
IUPAC NAME: (2-benzoylphenyl)methanesulfonic acid
SYSTEMATIC NAME: [2-(phenylcarbonyl)phenyl]methanesulfonic acid
MOLECULAR FORMULA: C14H12O4S
MOLECULAR WEIGHT: 276.30768
SMILES: C1=CC=C(C=C1)C(=O)C2=CC=CC=C2CS(=O)(=O)O
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Product OPENEYE NAME: bis(2-naphthyl)iodonium bromide
CAS Name: bis(2-naphthalenyl)iodonium bromide
IUPAC NAME: dinaphthalen-2-yliodanium bromide
SYSTEMATIC NAME: dinaphthalen-2-yliodanium bromide
MOLECULAR FORMULA: C20H14BrI
MOLECULAR WEIGHT: 461.13363
SMILES: C1=CC=C2C=C(C=CC2=C1)[I+]C3=CC4=CC=CC=C4C=C3.[Br-]
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C8H11ClOS
MOLECULAR WEIGHT: 190.69034
SMILES: C[S+](=O)(C)C1=CC=CC=C1.[Cl-]
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Product OPENEYE NAME:
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SYSTEMATIC NAME:
MOLECULAR FORMULA: C8H11OS+
MOLECULAR WEIGHT: 155.23734
SMILES: C[S+](=O)(C)C1=CC=CC=C1
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MOLECULAR FORMULA: C10H12ClNO3S
MOLECULAR WEIGHT: 261.72518
SMILES: C[S+](=O)(C)C(=O)NC(=O)C1=CC=CC=C1.[Cl-]
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