Product OPENEYE NAME: 2-(3,5,5-trimethylhexanoyloxy)benzenesulfonic acid
CAS Name: 2-(3,5,5-trimethyl-1-oxohexoxy)benzenesulfonic acid
IUPAC NAME: 2-(3,5,5-trimethylhexanoyloxy)benzenesulfonic acid
SYSTEMATIC NAME: 2-(3,5,5-trimethylhexanoyloxy)benzenesulfonic acid
MOLECULAR FORMULA: C15H22O5S
MOLECULAR WEIGHT: 314.39718
SMILES: CC(CC(=O)OC1=CC=CC=C1S(=O)(=O)O)CC(C)(C)C
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Product OPENEYE NAME: methyl 4-(4-methoxycarbonyl-2,6-dimethyl-phenyl)-3,5-dimethyl-benzoate
CAS Name: 4-(4-methoxycarbonyl-2,6-dimethylphenyl)-3,5-dimethylbenzoic acid methyl ester
IUPAC NAME: methyl 4-(4-methoxycarbonyl-2,6-dimethylphenyl)-3,5-dimethylbenzoate
SYSTEMATIC NAME: methyl 4-(4-methoxycarbonyl-2,6-dimethyl-phenyl)-3,5-dimethyl-benzoate
MOLECULAR FORMULA: C20H22O4
MOLECULAR WEIGHT: 326.38628
SMILES: CC1=CC(=CC(=C1C2=C(C=C(C=C2C)C(=O)OC)C)C)C(=O)OC
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Product OPENEYE NAME: 4-(4-chlorocarbonyl-2,6-dimethyl-phenyl)-3,5-dimethyl-benzoyl chloride
CAS Name: 4-(4-carbonochloridoyl-2,6-dimethylphenyl)-3,5-dimethylbenzoyl chloride
IUPAC NAME: 4-(4-carbonochloridoyl-2,6-dimethylphenyl)-3,5-dimethylbenzoyl chloride
SYSTEMATIC NAME: 4-(4-carbonochloridoyl-2,6-dimethyl-phenyl)-3,5-dimethyl-benzoyl chloride
MOLECULAR FORMULA: C18H16Cl2O2
MOLECULAR WEIGHT: 335.22444
SMILES: CC1=CC(=CC(=C1C2=C(C=C(C=C2C)C(=O)Cl)C)C)C(=O)Cl
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Product OPENEYE NAME: N6,N6-diethyl-3-methyl-N2-phenyl-9H-fluorene-2,6-diamine
CAS Name: N6,N6-diethyl-3-methyl-N2-phenyl-9H-fluorene-2,6-diamine
IUPAC NAME: 6-N,6-N-diethyl-3-methyl-2-N-phenyl-9H-fluorene-2,6-diamine
SYSTEMATIC NAME: N6,N6-diethyl-3-methyl-N2-phenyl-9H-fluorene-2,6-diamine
MOLECULAR FORMULA: C24H26N2
MOLECULAR WEIGHT: 342.47664
SMILES: CCN(CC)C1=CC2=C(CC3=CC(=C(C=C32)C)NC4=CC=CC=C4)C=C1
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Product OPENEYE NAME: N2-(2-chlorophenyl)-N6,N6-diethyl-9H-fluorene-2,6-diamine
CAS Name: N2-(2-chlorophenyl)-N6,N6-diethyl-9H-fluorene-2,6-diamine
IUPAC NAME: 2-N-(2-chlorophenyl)-6-N,6-N-diethyl-9H-fluorene-2,6-diamine
SYSTEMATIC NAME: N2-(2-chlorophenyl)-N6,N6-diethyl-9H-fluorene-2,6-diamine
MOLECULAR FORMULA: C23H23ClN2
MOLECULAR WEIGHT: 362.89512
SMILES: CCN(CC)C1=CC2=C(CC3=C2C=CC(=C3)NC4=CC=CC=C4Cl)C=C1
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Product OPENEYE NAME: 3-chloro-N6,N6-diethyl-N2-phenyl-9H-fluorene-2,6-diamine
CAS Name: 3-chloro-N6,N6-diethyl-N2-phenyl-9H-fluorene-2,6-diamine
IUPAC NAME: 3-chloro-6-N,6-N-diethyl-2-N-phenyl-9H-fluorene-2,6-diamine
SYSTEMATIC NAME: 3-chloranyl-N6,N6-diethyl-N2-phenyl-9H-fluorene-2,6-diamine
MOLECULAR FORMULA: C23H23ClN2
MOLECULAR WEIGHT: 362.89512
SMILES: CCN(CC)C1=CC2=C(CC3=CC(=C(C=C32)Cl)NC4=CC=CC=C4)C=C1
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Product OPENEYE NAME: 1-naphthyl 4-hydroxybenzenesulfonate
CAS Name: 4-hydroxybenzenesulfonic acid 1-naphthalenyl ester
IUPAC NAME: naphthalen-1-yl 4-hydroxybenzenesulfonate
SYSTEMATIC NAME: naphthalen-1-yl 4-oxidanylbenzenesulfonate
MOLECULAR FORMULA: C16H12O4S
MOLECULAR WEIGHT: 300.32908
SMILES: C1=CC=C2C(=C1)C=CC=C2OS(=O)(=O)C3=CC=C(C=C3)O
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Product OPENEYE NAME: phenyl 4-hydroxynaphthalene-1-sulfonate
CAS Name: 4-hydroxy-1-naphthalenesulfonic acid phenyl ester
IUPAC NAME: phenyl 4-hydroxynaphthalene-1-sulfonate
SYSTEMATIC NAME: phenyl 4-oxidanylnaphthalene-1-sulfonate
MOLECULAR FORMULA: C16H12O4S
MOLECULAR WEIGHT: 300.32908
SMILES: C1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C3=CC=CC=C32)O
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Product OPENEYE NAME: (4-tert-butylphenyl) 4-hydroxybenzenesulfonate
CAS Name: 4-hydroxybenzenesulfonic acid (4-tert-butylphenyl) ester
IUPAC NAME: (4-tert-butylphenyl) 4-hydroxybenzenesulfonate
SYSTEMATIC NAME: (4-tert-butylphenyl) 4-oxidanylbenzenesulfonate
MOLECULAR FORMULA: C16H18O4S
MOLECULAR WEIGHT: 306.37672
SMILES: CC(C)(C)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)O
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Product OPENEYE NAME: (4-tert-butylphenyl) 4-hydroxynaphthalene-1-sulfonate
CAS Name: 4-hydroxy-1-naphthalenesulfonic acid (4-tert-butylphenyl) ester
IUPAC NAME: (4-tert-butylphenyl) 4-hydroxynaphthalene-1-sulfonate
SYSTEMATIC NAME: (4-tert-butylphenyl) 4-oxidanylnaphthalene-1-sulfonate
MOLECULAR FORMULA: C20H20O4S
MOLECULAR WEIGHT: 356.4354
SMILES: CC(C)(C)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C3=CC=CC=C32)O
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Product OPENEYE NAME: benzyl 7-hydroxynaphthalene-1-sulfonate
CAS Name: 7-hydroxy-1-naphthalenesulfonic acid (phenylmethyl) ester
IUPAC NAME: benzyl 7-hydroxynaphthalene-1-sulfonate
SYSTEMATIC NAME: (phenylmethyl) 7-oxidanylnaphthalene-1-sulfonate
MOLECULAR FORMULA: C17H14O4S
MOLECULAR WEIGHT: 314.35566
SMILES: C1=CC=C(C=C1)COS(=O)(=O)C2=CC=CC3=C2C=C(C=C3)O
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Product OPENEYE NAME: (2-oxo-2-prop-2-ynoxy-ethyl) 2-cyanoprop-2-enoate
CAS Name: 2-cyano-2-propenoic acid (2-oxo-2-prop-2-ynoxyethyl) ester
IUPAC NAME: (2-oxo-2-prop-2-ynoxyethyl) 2-cyanoprop-2-enoate
SYSTEMATIC NAME: (2-oxidanylidene-2-prop-2-ynoxy-ethyl) 2-cyanoprop-2-enoate
MOLECULAR FORMULA: C9H7NO4
MOLECULAR WEIGHT: 193.15618
SMILES: C=C(C#N)C(=O)OCC(=O)OCC#C
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Product OPENEYE NAME: phenyl N-[4-(2-formylhydrazino)phenyl]carbamate
CAS Name: N-[4-(formylhydrazo)phenyl]carbamic acid phenyl ester
IUPAC NAME: phenyl N-[4-(2-formylhydrazinyl)phenyl]carbamate
SYSTEMATIC NAME: phenyl N-[4-(2-methanoylhydrazinyl)phenyl]carbamate
MOLECULAR FORMULA: C14H13N3O3
MOLECULAR WEIGHT: 271.27132
SMILES: C1=CC=C(C=C1)OC(=O)NC2=CC=C(C=C2)NNC=O
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Product OPENEYE NAME: [3,9-diethyl-9-(hydroxymethyl)-1,5,7,11-tetraoxaspiro[5.5]undecan-3-yl]methanol
CAS Name: [3,9-diethyl-9-(hydroxymethyl)-1,5,7,11-tetraoxaspiro[5.5]undecan-3-yl]methanol
IUPAC NAME: [3,9-diethyl-9-(hydroxymethyl)-1,5,7,11-tetraoxaspiro[5.5]undecan-3-yl]methanol
SYSTEMATIC NAME: [3,9-diethyl-9-(hydroxymethyl)-1,5,7,11-tetraoxaspiro[5.5]undecan-3-yl]methanol
MOLECULAR FORMULA: C13H24O6
MOLECULAR WEIGHT: 276.32606
SMILES: CCC1(COC2(OC1)OCC(CO2)(CC)CO)CO
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Product OPENEYE NAME: 3-(2,2-dinitropropoxymethyl)-3-methyl-oxetane
CAS Name: 3-(2,2-dinitropropoxymethyl)-3-methyloxetane
IUPAC NAME: 3-(2,2-dinitropropoxymethyl)-3-methyloxetane
SYSTEMATIC NAME: 3-(2,2-dinitropropoxymethyl)-3-methyl-oxetane
MOLECULAR FORMULA: C8H14N2O6
MOLECULAR WEIGHT: 234.20656
SMILES: CC1(COC1)COCC(C)([N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: 2-[[4-(hydroxyamino)benzoyl]amino]pentanedioic acid
CAS Name: 2-[[[4-(hydroxyamino)phenyl]-oxomethyl]amino]pentanedioic acid
IUPAC NAME: 2-[[4-(hydroxyamino)benzoyl]amino]pentanedioic acid
SYSTEMATIC NAME: 2-[[4-(oxidanylamino)phenyl]carbonylamino]pentanedioic acid
MOLECULAR FORMULA: C12H14N2O6
MOLECULAR WEIGHT: 282.24936
SMILES: C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)NO
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Product OPENEYE NAME: 2,5-bis(1,1-dimethylhexyl)benzene-1,4-diol
CAS Name: 2,5-bis(2-methylheptan-2-yl)benzene-1,4-diol
IUPAC NAME: 2,5-bis(2-methylheptan-2-yl)benzene-1,4-diol
SYSTEMATIC NAME: 2,5-bis(2-methylheptan-2-yl)benzene-1,4-diol
MOLECULAR FORMULA: C22H38O2
MOLECULAR WEIGHT: 334.53592
SMILES: CCCCCC(C)(C)C1=CC(=C(C=C1O)C(C)(C)CCCCC)O
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Product OPENEYE NAME: (4-nitrophenyl) 4-decanoyloxybenzoate
CAS Name: 4-(1-oxodecoxy)benzoic acid (4-nitrophenyl) ester
IUPAC NAME: (4-nitrophenyl) 4-decanoyloxybenzoate
SYSTEMATIC NAME: (4-nitrophenyl) 4-decanoyloxybenzoate
MOLECULAR FORMULA: C23H27NO6
MOLECULAR WEIGHT: 413.46358
SMILES: CCCCCCCCCC(=O)OC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-]
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Product OPENEYE NAME: [4-(4-nitrophenyl)sulfanylcarbonylphenyl] nonanoate
CAS Name: nonanoic acid [4-[[(4-nitrophenyl)thio]-oxomethyl]phenyl] ester
IUPAC NAME: [4-(4-nitrophenyl)sulfanylcarbonylphenyl] nonanoate
SYSTEMATIC NAME: [4-(4-nitrophenyl)sulfanylcarbonylphenyl] nonanoate
MOLECULAR FORMULA: C22H25NO5S
MOLECULAR WEIGHT: 415.5026
SMILES: CCCCCCCCC(=O)OC1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)[N+](=O)[O-]
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Product OPENEYE NAME: 2-[4-[(E)-styryl]phenyl]-4,6-bis(trichloromethyl)-1,3,5-triazine
CAS Name: 2-[4-[(E)-2-phenylethenyl]phenyl]-4,6-bis(trichloromethyl)-1,3,5-triazine
IUPAC NAME: 2-[4-[(E)-2-phenylethenyl]phenyl]-4,6-bis(trichloromethyl)-1,3,5-triazine
SYSTEMATIC NAME: 2-[4-[(E)-2-phenylethenyl]phenyl]-4,6-bis(trichloromethyl)-1,3,5-triazine
MOLECULAR FORMULA: C19H11Cl6N3
MOLECULAR WEIGHT: 494.02874
SMILES: C1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)C3=NC(=NC(=N3)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl
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Product OPENEYE NAME: 2-[4-[(E)-2-(1-naphthyl)vinyl]phenyl]-4,6-bis(trichloromethyl)-1,3,5-triazine
CAS Name: 2-[4-[(E)-2-(1-naphthalenyl)ethenyl]phenyl]-4,6-bis(trichloromethyl)-1,3,5-triazine
IUPAC NAME: 2-[4-[(E)-2-naphthalen-1-ylethenyl]phenyl]-4,6-bis(trichloromethyl)-1,3,5-triazine
SYSTEMATIC NAME: 2-[4-[(E)-2-naphthalen-1-ylethenyl]phenyl]-4,6-bis(trichloromethyl)-1,3,5-triazine
MOLECULAR FORMULA: C23H13Cl6N3
MOLECULAR WEIGHT: 544.08742
SMILES: C1=CC=C2C(=C1)C=CC=C2/C=C/C3=CC=C(C=C3)C4=NC(=NC(=N4)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl
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Product OPENEYE NAME: 2-[4-[(E)-2-(p-tolyl)vinyl]phenyl]-4,6-bis(trichloromethyl)-1,3,5-triazine
CAS Name: 2-[4-[(E)-2-(4-methylphenyl)ethenyl]phenyl]-4,6-bis(trichloromethyl)-1,3,5-triazine
IUPAC NAME: 2-[4-[(E)-2-(4-methylphenyl)ethenyl]phenyl]-4,6-bis(trichloromethyl)-1,3,5-triazine
SYSTEMATIC NAME: 2-[4-[(E)-2-(4-methylphenyl)ethenyl]phenyl]-4,6-bis(trichloromethyl)-1,3,5-triazine
MOLECULAR FORMULA: C20H13Cl6N3
MOLECULAR WEIGHT: 508.05532
SMILES: CC1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)C3=NC(=NC(=N3)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl
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