3-[[1-[(3-methylphenyl)methyl]piperidin-4-yl]methylamino]-4-phenyl-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[[1-[(3-methylphenyl)methyl]piperidin-4-yl]methylamino]-4-phenyl-cyclobut-3-ene-1,2-dione Openeye Name: 3-[[1-(m-tolylmethyl)-4-piperidyl]methylamino]-4-phenyl-cyclobut-3-ene-1,2-dione CAS Name: 3-[[1-[(3-methylphenyl)methyl]-4-piperidinyl]methylamino]-4-phenylcyclobut-3-ene-1,2-dione IUPAC Name: 3-[[1-[(3-methylphenyl)methyl]piperidin-4-yl]methylamino]-4-phenylcyclobut-3-ene-1,2-dione Traditional Name: 3-[[1-(3-methylbenzyl)-4-piperidyl]methylamino]-4-phenyl-cyclobut-3-ene-1,2-quinone Formula: C24H26N2O2 MolecularWeight: 374.47544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCC(CC2)CNC3=C(C(=O)C3=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCC(CC2)CNC3=C(C(=O)C3=O)C4=CC=CC=C4

InChI

InChI=1S/C24H26N2O2/c1-17-6-5-7-19(14-17)16-26-12-10-18(11-13-26)15-25-22-21(23(27)24(22)28)20-8-3-2-4-9-20/h2-9,14,18,25H,10-13,15-16H2,1H3