methyl 13-cyclohexyl-3-(1-methylsulfonylpiperidin-3-yl)oxy-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylate

Systemtic Name: methyl 13-cyclohexyl-3-(1-methylsulfonylpiperidin-3-yl)oxy-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylate Openeye Name: methyl 13-cyclohexyl-3-[(1-methylsulfonyl-3-piperidyl)oxy]-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylate CAS Name: 13-cyclohexyl-3-[(1-methylsulfonyl-3-piperidinyl)oxy]-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid methyl ester IUPAC Name: methyl 13-cyclohexyl-3-(1-methylsulfonylpiperidin-3-yl)oxy-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylate Traditional Name: 13-cyclohexyl-3-[(1-mesyl-3-piperidyl)oxy]-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid methyl ester Formula: C30H36N2O6S MolecularWeight: 552.68164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=C3N2CCOC4=C3C=CC(=C4)OC5CCCN(C5)S(=O)(=O)C)C6CCCCC6

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=C3N2CCOC4=C3C=CC(=C4)OC5CCCN(C5)S(=O)(=O)C)C6CCCCC6

InChI

InChI=1S/C30H36N2O6S/c1-36-30(33)21-10-12-24-26(17-21)32-15-16-37-27-18-22(38-23-9-6-14-31(19-23)39(2,34)35)11-13-25(27)29(32)28(24)20-7-4-3-5-8-20/h10-13,17-18,20,23H,3-9,14-16,19H2,1-2H3