butyl 4-[[1-[(2-methylphenyl)methyl]-2-oxidanylidene-pyridin-3-yl]carbonylamino]benzoate

Systemtic Name: butyl 4-[[1-[(2-methylphenyl)methyl]-2-oxidanylidene-pyridin-3-yl]carbonylamino]benzoate Openeye Name: butyl 4-[[1-(o-tolylmethyl)-2-oxo-pyridine-3-carbonyl]amino]benzoate CAS Name: 4-[[[1-[(2-methylphenyl)methyl]-2-oxo-3-pyridinyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[1-[(2-methylphenyl)methyl]-2-oxopyridine-3-carbonyl]amino]benzoate Traditional Name: 4-[[2-keto-1-(2-methylbenzyl)nicotinoyl]amino]benzoic acid butyl ester Formula: C25H26N2O4 MolecularWeight: 418.48494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CN(C2=O)CC3=CC=CC=C3C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CN(C2=O)CC3=CC=CC=C3C

InChI

InChI=1S/C25H26N2O4/c1-3-4-16-31-25(30)19-11-13-21(14-12-19)26-23(28)22-10-7-15-27(24(22)29)17-20-9-6-5-8-18(20)2/h5-15H,3-4,16-17H2,1-2H3,(H,26,28)