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

Systemtic Name: 2-[3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-oxidanyl-propyl]isoindole-1,3-dione Openeye Name: 2-[3-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-2-hydroxy-propyl]isoindoline-1,3-dione CAS Name: 2-[3-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-2-hydroxypropyl]isoindole-1,3-dione IUPAC Name: 2-[3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-hydroxypropyl]isoindole-1,3-dione Traditional Name: 2-[3-[4-(5-chloro-2-methyl-phenyl)piperazino]-2-hydroxy-propyl]isoindoline-1,3-quinone Formula: C22H24ClN3O3 MolecularWeight: 413.89726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CC(CN3C(=O)C4=CC=CC=C4C3=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CC(CN3C(=O)C4=CC=CC=C4C3=O)O

InChI

InChI=1S/C22H24ClN3O3/c1-15-6-7-16(23)12-20(15)25-10-8-24(9-11-25)13-17(27)14-26-21(28)18-4-2-3-5-19(18)22(26)29/h2-7,12,17,27H,8-11,13-14H2,1H3