4-[(4-oxidanylidene-4-pyridin-3-yl-but-1-en-2-yl)amino]benzoic acid

Systemtic Name: 4-[(4-oxidanylidene-4-pyridin-3-yl-but-1-en-2-yl)amino]benzoic acid Openeye Name: 4-[[1-methylene-3-oxo-3-(3-pyridyl)propyl]amino]benzoic acid CAS Name: 4-[[4-oxo-4-(3-pyridinyl)but-1-en-2-yl]amino]benzoic acid IUPAC Name: 4-[(4-oxo-4-pyridin-3-ylbut-1-en-2-yl)amino]benzoic acid Traditional Name: 4-[1-[2-keto-2-(3-pyridyl)ethyl]vinylamino]benzoic acid Formula: C16H14N2O3 MolecularWeight: 282.29396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N2O3/c1-11(9-15(19)13-3-2-8-17-10-13)18-14-6-4-12(5-7-14)16(20)21/h2-8,10,18H,1,9H2,(H,20,21)