dimethyl 2-chloranyl-13-cyclohexyl-5-methyl-7H-indolo[2,1-a][2]benzazepine-6,10-dicarboxylate

Systemtic Name: dimethyl 2-chloranyl-13-cyclohexyl-5-methyl-7H-indolo[2,1-a][2]benzazepine-6,10-dicarboxylate Openeye Name: dimethyl 2-chloro-13-cyclohexyl-5-methyl-7H-indolo[2,1-a][2]benzazepine-6,10-dicarboxylate CAS Name: 2-chloro-13-cyclohexyl-5-methyl-7H-indolo[2,1-a][2]benzazepine-6,10-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-chloro-13-cyclohexyl-5-methyl-7H-indolo[2,1-a][2]benzazepine-6,10-dicarboxylate Traditional Name: 2-chloro-13-cyclohexyl-5-methyl-7H-indolo[2,1-a][2]benzazepine-6,10-dicarboxylic acid dimethyl ester Formula: C28H28ClNO4 MolecularWeight: 477.97922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CN2C3=C(C=CC(=C3)C(=O)OC)C(=C2C4=C1C=CC(=C4)Cl)C5CCCCC5)C(=O)OC

Isomeric SMILES

CC1=C(CN2C3=C(C=CC(=C3)C(=O)OC)C(=C2C4=C1C=CC(=C4)Cl)C5CCCCC5)C(=O)OC

InChI

InChI=1S/C28H28ClNO4/c1-16-20-12-10-19(29)14-22(20)26-25(17-7-5-4-6-8-17)21-11-9-18(27(31)33-2)13-24(21)30(26)15-23(16)28(32)34-3/h9-14,17H,4-8,15H2,1-3H3