tert-butyl 13-cyclohexyl-3-methoxy-6-(3-morpholin-4-ylcarbonylpyridin-2-yl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylate

Systemtic Name: tert-butyl 13-cyclohexyl-3-methoxy-6-(3-morpholin-4-ylcarbonylpyridin-2-yl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylate Openeye Name: tert-butyl 13-cyclohexyl-3-methoxy-6-[3-(morpholine-4-carbonyl)-2-pyridyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylate CAS Name: 13-cyclohexyl-3-methoxy-6-[3-[4-morpholinyl(oxo)methyl]-2-pyridinyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 13-cyclohexyl-3-methoxy-6-[3-(morpholine-4-carbonyl)pyridin-2-yl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylate Traditional Name: 13-cyclohexyl-3-methoxy-6-[3-(morpholine-4-carbonyl)-2-pyridyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid tert-butyl ester Formula: C39H43N3O5 MolecularWeight: 633.77582

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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(C=CC=N5)C(=O)N6CCOCC6)C7CCCCC7

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC2=C(C=C1)C(=C3N2CC(=CC4=C3C=CC(=C4)OC)C5=C(C=CC=N5)C(=O)N6CCOCC6)C7CCCCC7

InChI

InChI=1S/C39H43N3O5/c1-39(2,3)47-38(44)26-12-14-31-33(23-26)42-24-28(35-32(11-8-16-40-35)37(43)41-17-19-46-20-18-41)21-27-22-29(45-4)13-15-30(27)36(42)34(31)25-9-6-5-7-10-25/h8,11-16,21-23,25H,5-7,9-10,17-20,24H2,1-4H3