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

Systemtic Name: 2-[2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[4-(5-chloro-2-methyl-phenyl)piperazino]ethyl]isoindoline-1,3-quinone Formula: C21H22ClN3O2 MolecularWeight: 383.87128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H22ClN3O2/c1-15-6-7-16(22)14-19(15)24-11-8-23(9-12-24)10-13-25-20(26)17-4-2-3-5-18(17)21(25)27/h2-7,14H,8-13H2,1H3