2-(2-methylphenyl)-1,3-bis(oxidanylidene)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]isoindole-5-carboxamide

Systemtic Name: 2-(2-methylphenyl)-1,3-bis(oxidanylidene)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]isoindole-5-carboxamide Openeye Name: 2-(o-tolyl)-1,3-dioxo-N-[3-(2-oxoazepan-1-yl)propyl]isoindoline-5-carboxamide CAS Name: 2-(2-methylphenyl)-1,3-dioxo-N-[3-(2-oxo-1-azepanyl)propyl]-5-isoindolecarboxamide IUPAC Name: 2-(2-methylphenyl)-1,3-dioxo-N-[3-(2-oxoazepan-1-yl)propyl]isoindole-5-carboxamide Traditional Name: 1,3-diketo-N-[3-(2-ketoazepan-1-yl)propyl]-2-(o-tolyl)isoindoline-5-carboxamide Formula: C25H27N3O4 MolecularWeight: 433.49958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCCCN4CCCCCC4=O

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCCCN4CCCCCC4=O

InChI

InChI=1S/C25H27N3O4/c1-17-8-4-5-9-21(17)28-24(31)19-12-11-18(16-20(19)25(28)32)23(30)26-13-7-15-27-14-6-2-3-10-22(27)29/h4-5,8-9,11-12,16H,2-3,6-7,10,13-15H2,1H3,(H,26,30)