Product OPENEYE NAME: 4-(dibutylsulfamoyl)benzoic acid
CAS Name: 4-(dibutylsulfamoyl)benzoic acid
IUPAC NAME: 4-(dibutylsulfamoyl)benzoic acid
SYSTEMATIC NAME: 4-(dibutylsulfamoyl)benzoic acid
MOLECULAR FORMULA: C15H23NO4S
MOLECULAR WEIGHT: 313.41242
SMILES: CCCCN(CCCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)O
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Product OPENEYE NAME: (4-aminophenyl)sulfonylurea
CAS Name: (4-aminophenyl)sulfonylurea
IUPAC NAME: (4-aminophenyl)sulfonylurea
SYSTEMATIC NAME: 1-(4-aminophenyl)sulfonylurea
MOLECULAR FORMULA: C7H9N3O3S
MOLECULAR WEIGHT: 215.22966
SMILES: C1=CC(=CC=C1N)S(=O)(=O)NC(=O)N
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Product OPENEYE NAME: 4-[4-(dimethylamino)phenyl]azobenzenesulfonic acid
CAS Name: 4-[4-(dimethylamino)phenyl]azobenzenesulfonic acid
IUPAC NAME: 4-[[4-(dimethylamino)phenyl]diazenyl]benzenesulfonic acid
SYSTEMATIC NAME: 4-[[4-(dimethylamino)phenyl]diazenyl]benzenesulfonic acid
MOLECULAR FORMULA: C14H15N3O3S
MOLECULAR WEIGHT: 305.3522
SMILES: CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)S(=O)(=O)O
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Product OPENEYE NAME: 2,6,6-trimethylnorpinan-3-one
CAS Name: 4,6,6-trimethyl-3-bicyclo[3.1.1]heptanone
IUPAC NAME: 4,6,6-trimethylbicyclo[3.1.1]heptan-3-one
SYSTEMATIC NAME: 4,6,6-trimethylbicyclo[3.1.1]heptan-3-one
MOLECULAR FORMULA: C10H16O
MOLECULAR WEIGHT: 152.23344
SMILES: CC1C2CC(C2(C)C)CC1=O
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Product OPENEYE NAME: methyl 2-methylpropanoate
CAS Name: 2-methylpropanoic acid methyl ester
IUPAC NAME: methyl 2-methylpropanoate
SYSTEMATIC NAME: methyl 2-methylpropanoate
MOLECULAR FORMULA: C5H10O2
MOLECULAR WEIGHT: 102.1317
SMILES: CC(C)C(=O)OC
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Product OPENEYE NAME: methyl 2-hydroxypropanoate
CAS Name: 2-hydroxypropanoic acid methyl ester
IUPAC NAME: methyl 2-hydroxypropanoate
SYSTEMATIC NAME: methyl 2-oxidanylpropanoate
MOLECULAR FORMULA: C4H8O3
MOLECULAR WEIGHT: 104.10452
SMILES: CC(C(=O)OC)O
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Product OPENEYE NAME: zinc oxalate
CAS Name: zinc oxalate
IUPAC NAME: zinc oxalate
SYSTEMATIC NAME: zinc ethanedioate
MOLECULAR FORMULA: C2O4Zn
MOLECULAR WEIGHT: 153.428
SMILES: C(=O)(C(=O)[O-])[O-].[Zn+2]
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Product OPENEYE NAME: 8-hydroxy-7-iodo-quinoline-5-sulfonic acid
CAS Name: 8-hydroxy-7-iodo-5-quinolinesulfonic acid
IUPAC NAME: 8-hydroxy-7-iodoquinoline-5-sulfonic acid
SYSTEMATIC NAME: 7-iodanyl-8-oxidanyl-quinoline-5-sulfonic acid
MOLECULAR FORMULA: C9H6INO4S
MOLECULAR WEIGHT: 351.11771
SMILES: C1=CC2=C(C(=C(C=C2S(=O)(=O)O)I)O)N=C1
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Product OPENEYE NAME: 1-(3-chloropropyl)aziridin-1-ium; 2,4,6-trinitrobenzenesulfonate
CAS Name: 1-(3-chloropropyl)aziridin-1-ium; 2,4,6-trinitrobenzenesulfonate
IUPAC NAME: 1-(3-chloropropyl)aziridin-1-ium; 2,4,6-trinitrobenzenesulfonate
SYSTEMATIC NAME: 1-(3-chloranylpropyl)aziridin-1-ium; 2,4,6-trinitrobenzenesulfonate
MOLECULAR FORMULA: C11H13ClN4O9S
MOLECULAR WEIGHT: 412.76032
SMILES: C1C[NH+]1CCCCl.C1=C(C=C(C(=C1[N+](=O)[O-])S(=O)(=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: 2,4,6-trinitrobenzenesulfonic acid
CAS Name: 2,4,6-trinitrobenzenesulfonic acid
IUPAC NAME: 2,4,6-trinitrobenzenesulfonic acid
SYSTEMATIC NAME: 2,4,6-trinitrobenzenesulfonic acid
MOLECULAR FORMULA: C6H3N3O9S
MOLECULAR WEIGHT: 293.16772
SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])S(=O)(=O)O)[N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: 1-(3-chloropropyl)aziridine
CAS Name: 1-(3-chloropropyl)aziridine
IUPAC NAME: 1-(3-chloropropyl)aziridine
SYSTEMATIC NAME: 1-(3-chloranylpropyl)aziridine
MOLECULAR FORMULA: C5H10ClN
MOLECULAR WEIGHT: 119.5926
SMILES: C1CN1CCCCl
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Product OPENEYE NAME: ethyl 2,2-bis(2-hydroxy-4-oxo-chromen-3-yl)acetate
CAS Name: 2,2-bis(2-hydroxy-4-oxo-1-benzopyran-3-yl)acetic acid ethyl ester
IUPAC NAME: ethyl 2,2-bis(2-hydroxy-4-oxochromen-3-yl)acetate
SYSTEMATIC NAME: ethyl 2,2-bis(2-oxidanyl-4-oxidanylidene-chromen-3-yl)ethanoate
MOLECULAR FORMULA: C22H16O8
MOLECULAR WEIGHT: 408.35764
SMILES: CCOC(=O)C(C1=C(OC2=CC=CC=C2C1=O)O)C3=C(OC4=CC=CC=C4C3=O)O
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Product OPENEYE NAME: disodium 2-(2,4,5,7-tetrabromo-3-oxido-6-oxo-xanthen-9-yl)benzoate
CAS Name: disodium 2-(2,4,5,7-tetrabromo-3-oxido-6-oxo-9-xanthenyl)benzoate
IUPAC NAME: disodium 2-(2,4,5,7-tetrabromo-3-oxido-6-oxoxanthen-9-yl)benzoate
SYSTEMATIC NAME: disodium 2-[2,4,5,7-tetrakis(bromanyl)-3-oxidanidyl-6-oxidanylidene-xanthen-9-yl]benzoate
MOLECULAR FORMULA: C20H6Br4Na2O5
MOLECULAR WEIGHT: 691.85418
SMILES: C1=CC=C(C(=C1)C2=C3C=C(C(=O)C(=C3OC4=C(C(=C(C=C24)Br)[O-])Br)Br)Br)C(=O)[O-].[Na+].[Na+]
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Product OPENEYE NAME: 2-(2,4,5,7-tetrabromo-3-hydroxy-6-oxo-xanthen-9-yl)benzoic acid
CAS Name: 2-(2,4,5,7-tetrabromo-3-hydroxy-6-oxo-9-xanthenyl)benzoic acid
IUPAC NAME: 2-(2,4,5,7-tetrabromo-3-hydroxy-6-oxoxanthen-9-yl)benzoic acid
SYSTEMATIC NAME: 2-[2,4,5,7-tetrakis(bromanyl)-3-oxidanyl-6-oxidanylidene-xanthen-9-yl]benzoic acid
MOLECULAR FORMULA: C20H8Br4O5
MOLECULAR WEIGHT: 647.89052
SMILES: C1=CC=C(C(=C1)C2=C3C=C(C(=O)C(=C3OC4=C(C(=C(C=C24)Br)O)Br)Br)Br)C(=O)O
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Product OPENEYE NAME: phenalen-1-one
CAS Name: 1-phenalenone
IUPAC NAME: phenalen-1-one
SYSTEMATIC NAME: phenalen-1-one
MOLECULAR FORMULA: C13H8O
MOLECULAR WEIGHT: 180.20202
SMILES: C1=CC2=C3C(=C1)C=CC(=O)C3=CC=C2
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H18N2O
MOLECULAR WEIGHT: 254.32692
SMILES: CN1CC(=CC2C1CC3=CNC4=CC=CC2=C34)CO
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Product OPENEYE NAME: 2-hydroxy-3-isopropyl-6-methyl-benzoic acid
CAS Name: 2-hydroxy-6-methyl-3-propan-2-ylbenzoic acid
IUPAC NAME: 2-hydroxy-6-methyl-3-propan-2-ylbenzoic acid
SYSTEMATIC NAME: 6-methyl-2-oxidanyl-3-propan-2-yl-benzoic acid
MOLECULAR FORMULA: C11H14O3
MOLECULAR WEIGHT: 194.22706
SMILES: CC1=C(C(=C(C=C1)C(C)C)O)C(=O)O
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Product OPENEYE NAME: 1-[2-(diethylamino)ethylamino]-4-methyl-thioxanthen-9-one hydrochloride
CAS Name: 1-[2-(diethylamino)ethylamino]-4-methyl-9-thioxanthenone hydrochloride
IUPAC NAME: 1-[2-(diethylamino)ethylamino]-4-methylthioxanthen-9-one hydrochloride
SYSTEMATIC NAME: 1-[2-(diethylamino)ethylamino]-4-methyl-thioxanthen-9-one hydrochloride
MOLECULAR FORMULA: C20H25ClN2OS
MOLECULAR WEIGHT: 376.9433
SMILES: CCN(CC)CCNC1=C2C(=C(C=C1)C)SC3=CC=CC=C3C2=O.Cl
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Product OPENEYE NAME: 5,8-dihydroxy-2-phenyl-chromen-4-one
CAS Name: 5,8-dihydroxy-2-phenyl-1-benzopyran-4-one
IUPAC NAME: 5,8-dihydroxy-2-phenylchromen-4-one
SYSTEMATIC NAME: 5,8-bis(oxidanyl)-2-phenyl-chromen-4-one
MOLECULAR FORMULA: C15H10O4
MOLECULAR WEIGHT: 254.2375
SMILES: C1=CC=C(C=C1)C2=CC(=O)C3=C(C=CC(=C3O2)O)O
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Product OPENEYE NAME: 2,5-dihydroxy-3,6-diphenyl-1,4-benzoquinone
CAS Name: 2,5-dihydroxy-3,6-diphenylcyclohexa-2,5-diene-1,4-dione
IUPAC NAME: 2,5-dihydroxy-3,6-diphenylcyclohexa-2,5-diene-1,4-dione
SYSTEMATIC NAME: 2,5-bis(oxidanyl)-3,6-diphenyl-cyclohexa-2,5-diene-1,4-dione
MOLECULAR FORMULA: C18H12O4
MOLECULAR WEIGHT: 292.28548
SMILES: C1=CC=C(C=C1)C2=C(C(=O)C(=C(C2=O)O)C3=CC=CC=C3)O
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