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

Systemtic Name: propan-2-yl 1,1-dimethyl-3-(3-morpholin-4-ylpropylcarbamoyl)-2,6-dihydroazepino[4,5-b]indole-5-carboxylate Openeye Name: isopropyl 1,1-dimethyl-3-(3-morpholinopropylcarbamoyl)-2,6-dihydroazepino[4,5-b]indole-5-carboxylate CAS Name: 1,1-dimethyl-3-[[3-(4-morpholinyl)propylamino]-oxomethyl]-2,6-dihydroazepino[4,5-b]indole-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1,1-dimethyl-3-(3-morpholin-4-ylpropylcarbamoyl)-2,6-dihydroazepino[4,5-b]indole-5-carboxylate Traditional Name: 1,1-dimethyl-3-(3-morpholinopropylcarbamoyl)-2,6-dihydroazepin[4,5-b]indole-5-carboxylic acid isopropyl ester Formula: C26H36N4O4 MolecularWeight: 468.58844

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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)NCCCN4CCOCC4

Isomeric SMILES

CC(C)OC(=O)C1=CN(CC(C2=C1NC3=CC=CC=C32)(C)C)C(=O)NCCCN4CCOCC4

InChI

InChI=1S/C26H36N4O4/c1-18(2)34-24(31)20-16-30(25(32)27-10-7-11-29-12-14-33-15-13-29)17-26(3,4)22-19-8-5-6-9-21(19)28-23(20)22/h5-6,8-9,16,18,28H,7,10-15,17H2,1-4H3,(H,27,32)