2-(2-methylphenyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: 2-(2-methylphenyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-[(1-morpholinocyclohexyl)methyl]-2-(o-tolyl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-(2-methylphenyl)-N-[[1-(4-morpholinyl)cyclohexyl]methyl]-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-(2-methylphenyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]-1,3-dioxoisoindole-5-carboxamide Traditional Name: 1,3-diketo-N-[(1-morpholinocyclohexyl)methyl]-2-(o-tolyl)isoindoline-5-carboxamide Formula: C27H31N3O4 MolecularWeight: 461.55274

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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)NCC4(CCCCC4)N5CCOCC5

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCC4(CCCCC4)N5CCOCC5

InChI

InChI=1S/C27H31N3O4/c1-19-7-3-4-8-23(19)30-25(32)21-10-9-20(17-22(21)26(30)33)24(31)28-18-27(11-5-2-6-12-27)29-13-15-34-16-14-29/h3-4,7-10,17H,2,5-6,11-16,18H2,1H3,(H,28,31)