methyl 13-cyclohexyl-4-(2-oxidanylidene-2-piperidin-1-yl-ethoxy)-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylate

Systemtic Name: methyl 13-cyclohexyl-4-(2-oxidanylidene-2-piperidin-1-yl-ethoxy)-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylate Openeye Name: methyl 13-cyclohexyl-4-[2-oxo-2-(1-piperidyl)ethoxy]-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylate CAS Name: 13-cyclohexyl-4-[2-oxo-2-(1-piperidinyl)ethoxy]-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid methyl ester IUPAC Name: methyl 13-cyclohexyl-4-(2-oxo-2-piperidin-1-ylethoxy)-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylate Traditional Name: 13-cyclohexyl-4-(2-keto-2-piperidino-ethoxy)-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid methyl ester Formula: C31H36N2O5 MolecularWeight: 516.62794

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=C3N2CCOC4=C3C=CC=C4OCC(=O)N5CCCCC5)C6CCCCC6

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=C3N2CCOC4=C3C=CC=C4OCC(=O)N5CCCCC5)C6CCCCC6

InChI

InChI=1S/C31H36N2O5/c1-36-31(35)22-13-14-23-25(19-22)33-17-18-37-30-24(29(33)28(23)21-9-4-2-5-10-21)11-8-12-26(30)38-20-27(34)32-15-6-3-7-16-32/h8,11-14,19,21H,2-7,9-10,15-18,20H2,1H3