2-[4-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione Openeye Name: 2-[4-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-4-oxo-butyl]isoindoline-1,3-dione CAS Name: 2-[4-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-4-oxobutyl]isoindole-1,3-dione IUPAC Name: 2-[4-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-4-oxobutyl]isoindole-1,3-dione Traditional Name: 2-[4-[4-(5-chloro-2-methyl-phenyl)piperazino]-4-keto-butyl]isoindoline-1,3-quinone Formula: C23H24ClN3O3 MolecularWeight: 425.90796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H24ClN3O3/c1-16-8-9-17(24)15-20(16)25-11-13-26(14-12-25)21(28)7-4-10-27-22(29)18-5-2-3-6-19(18)23(27)30/h2-3,5-6,8-9,15H,4,7,10-14H2,1H3