9-[4-(2-methylpropyl)phenyl]-2-oxidanyl-6,11-dihydro-5H-benzo[a]carbazole-3-carboxylic acid

Systemtic Name: 9-[4-(2-methylpropyl)phenyl]-2-oxidanyl-6,11-dihydro-5H-benzo[a]carbazole-3-carboxylic acid Openeye Name: 2-hydroxy-9-(4-isobutylphenyl)-6,11-dihydro-5H-benzo[a]carbazole-3-carboxylic acid CAS Name: 2-hydroxy-9-[4-(2-methylpropyl)phenyl]-6,11-dihydro-5H-benzo[a]carbazole-3-carboxylic acid IUPAC Name: 2-hydroxy-9-[4-(2-methylpropyl)phenyl]-6,11-dihydro-5H-benzo[a]carbazole-3-carboxylic acid Traditional Name: 2-hydroxy-9-(4-isobutylphenyl)-6,11-dihydro-5H-benzo[a]carbazole-3-carboxylic acid Formula: C27H25NO3 MolecularWeight: 411.4923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C2=CC3=C(C=C2)C4=C(N3)C5=CC(=C(C=C5CC4)C(=O)O)O

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C2=CC3=C(C=C2)C4=C(N3)C5=CC(=C(C=C5CC4)C(=O)O)O

InChI

InChI=1S/C27H25NO3/c1-15(2)11-16-3-5-17(6-4-16)18-7-9-20-21-10-8-19-12-23(27(30)31)25(29)14-22(19)26(21)28-24(20)13-18/h3-7,9,12-15,28-29H,8,10-11H2,1-2H3,(H,30,31)