CAS RN: 64838-03-5
CAS Name: 4-(5-phenylpentyl)-1H-indole-2,3-dione
OPENEYE Name: 4-(5-phenylpentyl)indoline-2,3-dione
IUPAC Name: 4-(5-phenylpentyl)-1H-indole-2,3-dione
SYSTEMATIC NAME: 4-(5-phenylpentyl)-1H-indole-2,3-dione
MOLECULAR FORMULA: C19H19NO2
MOLECULAR WEIGHT: 293.35966
SMILES: C1=CC=C(C=C1)CCCCCC2=C3C(=CC=C2)NC(=O)C3=O
Structure:
CAS RN: 7325-84-0
CAS Name: 1,8,10-trihydroxy-10H-anthracen-9-one
OPENEYE Name: 1,8,10-trihydroxy-10H-anthracen-9-one
IUPAC Name: 1,8,10-trihydroxy-10H-anthracen-9-one
SYSTEMATIC NAME: 1,8,10-tris(oxidanyl)-10H-anthracen-9-one
MOLECULAR FORMULA: C14H10O4
MOLECULAR WEIGHT: 242.2268
SMILES: C1=CC2=C(C(=C1)O)C(=O)C3=C(C2O)C=CC=C3O
Structure:
CAS RN: 20057-16-3
CAS Name: 10-methyl-5H-phenazine
OPENEYE Name: 10-methyl-5H-phenazine
IUPAC Name: 10-methyl-5H-phenazine
SYSTEMATIC NAME: 10-methyl-5H-phenazine
MOLECULAR FORMULA: C13H12N2
MOLECULAR WEIGHT: 196.24778
SMILES: CN1C2=CC=CC=C2NC3=CC=CC=C31
Structure:
CAS RN: 67859-46-5
CAS Name: 1,2,3-trichloro-4-iodobenzene
OPENEYE Name: 1,2,3-trichloro-4-iodo-benzene
IUPAC Name: 1,2,3-trichloro-4-iodobenzene
SYSTEMATIC NAME: 1,2,3-tris(chloranyl)-4-iodanyl-benzene
MOLECULAR FORMULA: C6H2Cl3I
MOLECULAR WEIGHT: 307.34355
SMILES: C1=CC(=C(C(=C1Cl)Cl)Cl)I
Structure:
CAS RN: 67113-62-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H14O4
MOLECULAR WEIGHT: 318.32276
SMILES: C1=CC=C2C3=C4C5=C(C=CC=C5C6OC(C4(O6)C(C2=C1)O)O)C=C3
Structure:
CAS RN: 67112-57-6
CAS Name: 5,6-dihydro-4H-benzo[a]pyrene-4,5,5a,6-tetrol
OPENEYE Name: 5,6-dihydro-4H-benzo[a]pyrene-4,5,5a,6-tetrol
IUPAC Name: 5,6-dihydro-4H-benzo[a]pyrene-4,5,5a,6-tetrol
SYSTEMATIC NAME: 5,6-dihydro-4H-benzo[a]pyrene-4,5,5a,6-tetrol
MOLECULAR FORMULA: C20H16O4
MOLECULAR WEIGHT: 320.33864
SMILES: C1=CC=C2C3=C4C5=C(C=CC=C5C(C(C4(C(C2=C1)O)O)O)O)C=C3
Structure:
CAS RN: 6668-24-2
CAS Name: (3R,4S)-3,4-dihydrophenanthrene-3,4-diol
OPENEYE Name: (3R,4S)-3,4-dihydrophenanthrene-3,4-diol
IUPAC Name: (3R,4S)-3,4-dihydrophenanthrene-3,4-diol
SYSTEMATIC NAME: (3R,4S)-3,4-dihydrophenanthrene-3,4-diol
MOLECULAR FORMULA: C14H12O2
MOLECULAR WEIGHT: 212.24388
SMILES: C1=CC=C2C(=C1)C=CC3=C2[C@@H]([C@@H](C=C3)O)O
Structure:
CAS RN: 66671-82-7
CAS Name: 1,1,2,2-tetrachlorocyclohexane
OPENEYE Name: 1,1,2,2-tetrachlorocyclohexane
IUPAC Name: 1,1,2,2-tetrachlorocyclohexane
SYSTEMATIC NAME: 1,1,2,2-tetrakis(chloranyl)cyclohexane
MOLECULAR FORMULA: C6H8Cl4
MOLECULAR WEIGHT: 221.93972
SMILES: C1CCC(C(C1)(Cl)Cl)(Cl)Cl
Structure:
CAS RN: 60287-96-9
CAS Name: 9-methylbenzo[b][1,4]benzoxazepine
OPENEYE Name: 9-methylbenzo[b][1,4]benzoxazepine
IUPAC Name: 9-methylbenzo[b][1,4]benzoxazepine
SYSTEMATIC NAME: 9-methylbenzo[b][1,4]benzoxazepine
MOLECULAR FORMULA: C14H11NO
MOLECULAR WEIGHT: 209.24324
SMILES: CC1=CC2=C(C=C1)C=NC3=CC=CC=C3O2
Structure:
CAS RN: 6633-25-6
CAS Name: 2-propenoic acid [(8R,9S,13S,14S,17S)-13-methyl-3-(1-oxoprop-2-enoxy)-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] ester
OPENEYE Name: [(8R,9S,13S,14S,17S)-13-methyl-3-prop-2-enoyloxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] prop-2-enoate
IUPAC Name: [(8R,9S,13S,14S,17S)-13-methyl-3-prop-2-enoyloxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] prop-2-enoate
SYSTEMATIC NAME: [(8R,9S,13S,14S,17S)-13-methyl-3-prop-2-enoyloxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] prop-2-enoate
MOLECULAR FORMULA: C24H28O4
MOLECULAR WEIGHT: 380.47672
SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2OC(=O)C=C)CCC4=C3C=CC(=C4)OC(=O)C=C
Structure:
CAS RN: 6631-39-6
CAS Name: 1,4,9-trimethylpyrido[2,3-b]indol-1-ium iodide
OPENEYE Name: 1,4,9-trimethylpyrido[2,3-b]indol-1-ium iodide
IUPAC Name: 1,4,9-trimethylpyrido[2,3-b]indol-1-ium iodide
SYSTEMATIC NAME: 1,4,9-trimethylpyrido[2,3-b]indol-1-ium iodide
MOLECULAR FORMULA: C14H15IN2
MOLECULAR WEIGHT: 338.18677
SMILES: CC1=C2C3=CC=CC=C3N(C2=[N+](C=C1)C)C.[I-]
Structure:
CAS RN: 6631-33-0
CAS Name: 1,4-diphenylpyrido[2,3-b]indole
OPENEYE Name: 1,4-diphenylpyrido[2,3-b]indole
IUPAC Name: 1,4-diphenylpyrido[2,3-b]indole
SYSTEMATIC NAME: 1,4-diphenylpyrido[2,3-b]indole
MOLECULAR FORMULA: C23H16N2
MOLECULAR WEIGHT: 320.38654
SMILES: C1=CC=C(C=C1)C2=C3C4=CC=CC=C4N=C3N(C=C2)C5=CC=CC=C5
Structure:
CAS RN: 66214-44-6
CAS Name: 1,1-dichloro-2-propan-2-yloxypropane
OPENEYE Name: 1,1-dichloro-2-isopropoxy-propane
IUPAC Name: 1,1-dichloro-2-propan-2-yloxypropane
SYSTEMATIC NAME: 1,1-bis(chloranyl)-2-propan-2-yloxy-propane
MOLECULAR FORMULA: C6H12Cl2O
MOLECULAR WEIGHT: 171.06488
SMILES: CC(C)OC(C)C(Cl)Cl
Structure:
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