3-(4-methylphenyl)-4-(4-pyridin-2-ylpiperazin-1-yl)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(4-methylphenyl)-4-(4-pyridin-2-ylpiperazin-1-yl)cyclobut-3-ene-1,2-dione Openeye Name: 3-(p-tolyl)-4-[4-(2-pyridyl)piperazin-1-yl]cyclobut-3-ene-1,2-dione CAS Name: 3-(4-methylphenyl)-4-[4-(2-pyridinyl)-1-piperazinyl]cyclobut-3-ene-1,2-dione IUPAC Name: 3-(4-methylphenyl)-4-(4-pyridin-2-ylpiperazin-1-yl)cyclobut-3-ene-1,2-dione Traditional Name: 3-(p-tolyl)-4-[4-(2-pyridyl)piperazino]cyclobut-3-ene-1,2-quinone Formula: C20H19N3O2 MolecularWeight: 333.38376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=O)C2=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=O)C2=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C20H19N3O2/c1-14-5-7-15(8-6-14)17-18(20(25)19(17)24)23-12-10-22(11-13-23)16-4-2-3-9-21-16/h2-9H,10-13H2,1H3