(E)-4-oxidanylidene-4-[phenyl(pyridin-4-ylmethyl)amino]but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-[phenyl(pyridin-4-ylmethyl)amino]but-2-enoic acid Openeye Name: (E)-4-oxo-4-[N-(4-pyridylmethyl)anilino]but-2-enoic acid CAS Name: (E)-4-oxo-4-[N-(pyridin-4-ylmethyl)anilino]-2-butenoic acid IUPAC Name: (E)-4-oxo-4-[N-(pyridin-4-ylmethyl)anilino]but-2-enoic acid Traditional Name: (E)-4-keto-4-[N-(4-pyridylmethyl)anilino]but-2-enoic acid Formula: C16H14N2O3 MolecularWeight: 282.29396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CC2=CC=NC=C2)C(=O)C=CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N(CC2=CC=NC=C2)C(=O)/C=C/C(=O)O

InChI

InChI=1S/C16H14N2O3/c19-15(6-7-16(20)21)18(14-4-2-1-3-5-14)12-13-8-10-17-11-9-13/h1-11H,12H2,(H,20,21)/b7-6+