3-[[4-(3,5-dimethylpiperidin-1-yl)carbonylphenyl]methylamino]-4-pyrrolidin-1-yl-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[[4-(3,5-dimethylpiperidin-1-yl)carbonylphenyl]methylamino]-4-pyrrolidin-1-yl-cyclobut-3-ene-1,2-dione Openeye Name: 3-[[4-(3,5-dimethylpiperidine-1-carbonyl)phenyl]methylamino]-4-pyrrolidin-1-yl-cyclobut-3-ene-1,2-dione CAS Name: 3-[[4-[(3,5-dimethyl-1-piperidinyl)-oxomethyl]phenyl]methylamino]-4-(1-pyrrolidinyl)cyclobut-3-ene-1,2-dione IUPAC Name: 3-[[4-(3,5-dimethylpiperidine-1-carbonyl)phenyl]methylamino]-4-pyrrolidin-1-ylcyclobut-3-ene-1,2-dione Traditional Name: 3-[[4-(3,5-dimethylpiperidine-1-carbonyl)benzyl]amino]-4-pyrrolidino-cyclobut-3-ene-1,2-quinone Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C2=CC=C(C=C2)CNC3=C(C(=O)C3=O)N4CCCC4)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)C2=CC=C(C=C2)CNC3=C(C(=O)C3=O)N4CCCC4)C

InChI

InChI=1S/C23H29N3O3/c1-15-11-16(2)14-26(13-15)23(29)18-7-5-17(6-8-18)12-24-19-20(22(28)21(19)27)25-9-3-4-10-25/h5-8,15-16,24H,3-4,9-14H2,1-2H3