propan-2-yl 1,1-dimethyl-3-(2-morpholin-4-ylethylcarbamoyl)-2,6-dihydroazepino[4,5-b]indole-5-carboxylate

Systemtic Name: propan-2-yl 1,1-dimethyl-3-(2-morpholin-4-ylethylcarbamoyl)-2,6-dihydroazepino[4,5-b]indole-5-carboxylate Openeye Name: isopropyl 1,1-dimethyl-3-(2-morpholinoethylcarbamoyl)-2,6-dihydroazepino[4,5-b]indole-5-carboxylate CAS Name: 1,1-dimethyl-3-[[2-(4-morpholinyl)ethylamino]-oxomethyl]-2,6-dihydroazepino[4,5-b]indole-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1,1-dimethyl-3-(2-morpholin-4-ylethylcarbamoyl)-2,6-dihydroazepino[4,5-b]indole-5-carboxylate Traditional Name: 1,1-dimethyl-3-(2-morpholinoethylcarbamoyl)-2,6-dihydroazepin[4,5-b]indole-5-carboxylic acid isopropyl ester Formula: C25H34N4O4 MolecularWeight: 454.56186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CN(CC(C2=C1NC3=CC=CC=C32)(C)C)C(=O)NCCN4CCOCC4

Isomeric SMILES

CC(C)OC(=O)C1=CN(CC(C2=C1NC3=CC=CC=C32)(C)C)C(=O)NCCN4CCOCC4

InChI

InChI=1S/C25H34N4O4/c1-17(2)33-23(30)19-15-29(24(31)26-9-10-28-11-13-32-14-12-28)16-25(3,4)21-18-7-5-6-8-20(18)27-22(19)21/h5-8,15,17,27H,9-14,16H2,1-4H3,(H,26,31)