3-[[4-(3-methylpiperidin-1-yl)carbonylphenyl]methylamino]-4-piperidin-1-yl-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[[4-(3-methylpiperidin-1-yl)carbonylphenyl]methylamino]-4-piperidin-1-yl-cyclobut-3-ene-1,2-dione Openeye Name: 3-[[4-(3-methylpiperidine-1-carbonyl)phenyl]methylamino]-4-(1-piperidyl)cyclobut-3-ene-1,2-dione CAS Name: 3-[[4-[(3-methyl-1-piperidinyl)-oxomethyl]phenyl]methylamino]-4-(1-piperidinyl)cyclobut-3-ene-1,2-dione IUPAC Name: 3-[[4-(3-methylpiperidine-1-carbonyl)phenyl]methylamino]-4-piperidin-1-ylcyclobut-3-ene-1,2-dione Traditional Name: 3-[[4-(3-methylpiperidine-1-carbonyl)benzyl]amino]-4-piperidino-cyclobut-3-ene-1,2-quinone Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2=CC=C(C=C2)CNC3=C(C(=O)C3=O)N4CCCCC4

Isomeric SMILES

CC1CCCN(C1)C(=O)C2=CC=C(C=C2)CNC3=C(C(=O)C3=O)N4CCCCC4

InChI

InChI=1S/C23H29N3O3/c1-16-6-5-13-26(15-16)23(29)18-9-7-17(8-10-18)14-24-19-20(22(28)21(19)27)25-11-3-2-4-12-25/h7-10,16,24H,2-6,11-15H2,1H3