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

Systemtic Name: 5-[4-(3-chloranyl-2-methyl-phenyl)piperazin-1-yl]carbonyl-2-(4-methylphenyl)isoindole-1,3-dione Openeye Name: 5-[4-(3-chloro-2-methyl-phenyl)piperazine-1-carbonyl]-2-(p-tolyl)isoindoline-1,3-dione CAS Name: 5-[[4-(3-chloro-2-methylphenyl)-1-piperazinyl]-oxomethyl]-2-(4-methylphenyl)isoindole-1,3-dione IUPAC Name: 5-[4-(3-chloro-2-methylphenyl)piperazine-1-carbonyl]-2-(4-methylphenyl)isoindole-1,3-dione Traditional Name: 5-[4-(3-chloro-2-methyl-phenyl)piperazine-1-carbonyl]-2-(p-tolyl)isoindoline-1,3-quinone Formula: C27H24ClN3O3 MolecularWeight: 473.95076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCN(CC4)C5=C(C(=CC=C5)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCN(CC4)C5=C(C(=CC=C5)Cl)C

InChI

InChI=1S/C27H24ClN3O3/c1-17-6-9-20(10-7-17)31-26(33)21-11-8-19(16-22(21)27(31)34)25(32)30-14-12-29(13-15-30)24-5-3-4-23(28)18(24)2/h3-11,16H,12-15H2,1-2H3