4-oxidanylidene-4-[4-(pyridin-3-ylcarbonylamino)phenyl]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[4-(pyridin-3-ylcarbonylamino)phenyl]butanoic acid Openeye Name: 4-oxo-4-[4-(pyridine-3-carbonylamino)phenyl]butanoic acid CAS Name: 4-oxo-4-[4-[[oxo(3-pyridinyl)methyl]amino]phenyl]butanoic acid IUPAC Name: 4-oxo-4-[4-(pyridine-3-carbonylamino)phenyl]butanoic acid Traditional Name: 4-keto-4-(4-nicotinamidophenyl)butyric acid Formula: C16H14N2O4 MolecularWeight: 298.29336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)NC2=CC=C(C=C2)C(=O)CCC(=O)O

Isomeric SMILES

C1=CC(=CN=C1)C(=O)NC2=CC=C(C=C2)C(=O)CCC(=O)O

InChI

InChI=1S/C16H14N2O4/c19-14(7-8-15(20)21)11-3-5-13(6-4-11)18-16(22)12-2-1-9-17-10-12/h1-6,9-10H,7-8H2,(H,18,22)(H,20,21)