2-[3-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxidanylidene-propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxidanylidene-propyl]isoindole-1,3-dione Openeye Name: 2-[3-[4-(o-tolylmethyl)-1,4-diazepan-1-yl]-3-oxo-propyl]isoindoline-1,3-dione CAS Name: 2-[3-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxopropyl]isoindole-1,3-dione IUPAC Name: 2-[3-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxopropyl]isoindole-1,3-dione Traditional Name: 2-[3-keto-3-[4-(2-methylbenzyl)-1,4-diazepan-1-yl]propyl]isoindoline-1,3-quinone Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCCN(CC2)C(=O)CCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC=CC=C1CN2CCCN(CC2)C(=O)CCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H27N3O3/c1-18-7-2-3-8-19(18)17-25-12-6-13-26(16-15-25)22(28)11-14-27-23(29)20-9-4-5-10-21(20)24(27)30/h2-5,7-10H,6,11-17H2,1H3