3-(3,4-dimethylphenyl)-4-[2-(2-methylpiperidin-1-yl)ethylamino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(3,4-dimethylphenyl)-4-[2-(2-methylpiperidin-1-yl)ethylamino]cyclobut-3-ene-1,2-dione Openeye Name: 3-(3,4-dimethylphenyl)-4-[2-(2-methyl-1-piperidyl)ethylamino]cyclobut-3-ene-1,2-dione CAS Name: 3-(3,4-dimethylphenyl)-4-[2-(2-methyl-1-piperidinyl)ethylamino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-(3,4-dimethylphenyl)-4-[2-(2-methylpiperidin-1-yl)ethylamino]cyclobut-3-ene-1,2-dione Traditional Name: 3-(3,4-dimethylphenyl)-4-[2-(2-methylpiperidino)ethylamino]cyclobut-3-ene-1,2-quinone Formula: C20H26N2O2 MolecularWeight: 326.43264

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCNC2=C(C(=O)C2=O)C3=CC(=C(C=C3)C)C

Isomeric SMILES

CC1CCCCN1CCNC2=C(C(=O)C2=O)C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C20H26N2O2/c1-13-7-8-16(12-14(13)2)17-18(20(24)19(17)23)21-9-11-22-10-5-4-6-15(22)3/h7-8,12,15,21H,4-6,9-11H2,1-3H3