3-[4-(3-chlorophenyl)piperazin-1-yl]-4-phenyl-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]-4-phenyl-cyclobut-3-ene-1,2-dione Openeye Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]-4-phenyl-cyclobut-3-ene-1,2-dione CAS Name: 3-[4-(3-chlorophenyl)-1-piperazinyl]-4-phenylcyclobut-3-ene-1,2-dione IUPAC Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]-4-phenylcyclobut-3-ene-1,2-dione Traditional Name: 3-[4-(3-chlorophenyl)piperazino]-4-phenyl-cyclobut-3-ene-1,2-quinone Formula: C20H17ClN2O2 MolecularWeight: 352.81418

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C(=O)C3=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C(=O)C3=O)C4=CC=CC=C4

InChI

InChI=1S/C20H17ClN2O2/c21-15-7-4-8-16(13-15)22-9-11-23(12-10-22)18-17(19(24)20(18)25)14-5-2-1-3-6-14/h1-8,13H,9-12H2