butyl 4-[[1-[(2,5-dimethylphenyl)methyl]-6-oxidanylidene-pyridin-3-yl]carbonylamino]benzoate

Systemtic Name: butyl 4-[[1-[(2,5-dimethylphenyl)methyl]-6-oxidanylidene-pyridin-3-yl]carbonylamino]benzoate Openeye Name: butyl 4-[[1-[(2,5-dimethylphenyl)methyl]-6-oxo-pyridine-3-carbonyl]amino]benzoate CAS Name: 4-[[[1-[(2,5-dimethylphenyl)methyl]-6-oxo-3-pyridinyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[1-[(2,5-dimethylphenyl)methyl]-6-oxopyridine-3-carbonyl]amino]benzoate Traditional Name: 4-[[1-(2,5-dimethylbenzyl)-6-keto-nicotinoyl]amino]benzoic acid butyl ester Formula: C26H28N2O4 MolecularWeight: 432.51152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CN(C(=O)C=C2)CC3=C(C=CC(=C3)C)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CN(C(=O)C=C2)CC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C26H28N2O4/c1-4-5-14-32-26(31)20-8-11-23(12-9-20)27-25(30)21-10-13-24(29)28(16-21)17-22-15-18(2)6-7-19(22)3/h6-13,15-16H,4-5,14,17H2,1-3H3,(H,27,30)