tert-butyl 13-cyclohexyl-3-methoxy-6-(2-methoxycarbonylthiophen-3-yl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylate

Systemtic Name: tert-butyl 13-cyclohexyl-3-methoxy-6-(2-methoxycarbonylthiophen-3-yl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylate Openeye Name: tert-butyl 13-cyclohexyl-3-methoxy-6-(2-methoxycarbonyl-3-thienyl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylate CAS Name: 13-cyclohexyl-3-methoxy-6-(2-methoxycarbonyl-3-thiophenyl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 13-cyclohexyl-3-methoxy-6-(2-methoxycarbonylthiophen-3-yl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylate Traditional Name: 6-(2-carbomethoxy-3-thienyl)-13-cyclohexyl-3-methoxy-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid tert-butyl ester Formula: C35H37NO5S MolecularWeight: 583.73698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC2=C(C=C1)C(=C3N2CC(=CC4=C3C=CC(=C4)OC)C5=C(SC=C5)C(=O)OC)C6CCCCC6

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC2=C(C=C1)C(=C3N2CC(=CC4=C3C=CC(=C4)OC)C5=C(SC=C5)C(=O)OC)C6CCCCC6

InChI

InChI=1S/C35H37NO5S/c1-35(2,3)41-33(37)22-11-13-28-29(19-22)36-20-24(27-15-16-42-32(27)34(38)40-5)17-23-18-25(39-4)12-14-26(23)31(36)30(28)21-9-7-6-8-10-21/h11-19,21H,6-10,20H2,1-5H3