2-[4-[4-(4-methylquinolin-2-yl)piperazin-1-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[4-(4-methylquinolin-2-yl)piperazin-1-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione Openeye Name: 2-[4-[4-(4-methyl-2-quinolyl)piperazin-1-yl]-4-oxo-butyl]isoindoline-1,3-dione CAS Name: 2-[4-[4-(4-methyl-2-quinolinyl)-1-piperazinyl]-4-oxobutyl]isoindole-1,3-dione IUPAC Name: 2-[4-[4-(4-methylquinolin-2-yl)piperazin-1-yl]-4-oxobutyl]isoindole-1,3-dione Traditional Name: 2-[4-keto-4-[4-(4-methyl-2-quinolyl)piperazino]butyl]isoindoline-1,3-quinone Formula: C26H26N4O3 MolecularWeight: 442.50964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)N3CCN(CC3)C(=O)CCCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)N3CCN(CC3)C(=O)CCCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C26H26N4O3/c1-18-17-23(27-22-10-5-4-7-19(18)22)28-13-15-29(16-14-28)24(31)11-6-12-30-25(32)20-8-2-3-9-21(20)26(30)33/h2-5,7-10,17H,6,11-16H2,1H3