4-butyl-1-[(4-methylpyridin-2-yl)amino]-1,2-diphenyl-pyrazolidin-1-ium-3,5-dione

Systemtic Name: 4-butyl-1-[(4-methylpyridin-2-yl)amino]-1,2-diphenyl-pyrazolidin-1-ium-3,5-dione Openeye Name: 4-butyl-1-[(4-methyl-2-pyridyl)amino]-1,2-diphenyl-pyrazolidin-1-ium-3,5-dione CAS Name: 4-butyl-1-[(4-methyl-2-pyridinyl)amino]-1,2-diphenylpyrazolidin-1-ium-3,5-dione IUPAC Name: 4-butyl-1-[(4-methylpyridin-2-yl)amino]-1,2-diphenylpyrazolidin-1-ium-3,5-dione Traditional Name: 4-butyl-1-[(4-methyl-2-pyridyl)amino]-1,2-diphenyl-pyrazolidin-1-ium-3,5-quinone Formula: C25H27N4O2+ MolecularWeight: 415.50748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=O)N([N+](C1=O)(C2=CC=CC=C2)NC3=NC=CC(=C3)C)C4=CC=CC=C4

Isomeric SMILES

CCCCC1C(=O)N([N+](C1=O)(C2=CC=CC=C2)NC3=NC=CC(=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C25H27N4O2/c1-3-4-15-22-24(30)28(20-11-7-5-8-12-20)29(25(22)31,21-13-9-6-10-14-21)27-23-18-19(2)16-17-26-23/h5-14,16-18,22H,3-4,15H2,1-2H3,(H,26,27)/q+1