13-cyclohexyl-3-methoxy-6-phenyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid

Systemtic Name: 13-cyclohexyl-3-methoxy-6-phenyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid Openeye Name: 13-cyclohexyl-3-methoxy-6-phenyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid CAS Name: 13-cyclohexyl-3-methoxy-6-phenyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid IUPAC Name: 13-cyclohexyl-3-methoxy-6-phenyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid Traditional Name: 13-cyclohexyl-3-methoxy-6-phenyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid Formula: C31H29NO3 MolecularWeight: 463.56686

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C(C4=C(N3CC(=C2)C5=CC=CC=C5)C=C(C=C4)C(=O)O)C6CCCCC6

Isomeric SMILES

COC1=CC2=C(C=C1)C3=C(C4=C(N3CC(=C2)C5=CC=CC=C5)C=C(C=C4)C(=O)O)C6CCCCC6

InChI

InChI=1S/C31H29NO3/c1-35-25-13-15-26-23(17-25)16-24(20-8-4-2-5-9-20)19-32-28-18-22(31(33)34)12-14-27(28)29(30(26)32)21-10-6-3-7-11-21/h2,4-5,8-9,12-18,21H,3,6-7,10-11,19H2,1H3,(H,33,34)