2-[(E)-3-methoxy-3-oxidanylidene-1-pyridin-4-yl-prop-1-en-2-yl]benzoic acid

Systemtic Name: 2-[(E)-3-methoxy-3-oxidanylidene-1-pyridin-4-yl-prop-1-en-2-yl]benzoic acid Openeye Name: 2-[(E)-1-methoxycarbonyl-2-(4-pyridyl)vinyl]benzoic acid CAS Name: 2-[(E)-3-methoxy-3-oxo-1-pyridin-4-ylprop-1-en-2-yl]benzoic acid IUPAC Name: 2-[(E)-3-methoxy-3-oxo-1-pyridin-4-ylprop-1-en-2-yl]benzoic acid Traditional Name: 2-[(E)-1-carbomethoxy-2-(4-pyridyl)vinyl]benzoic acid Formula: C16H13NO4 MolecularWeight: 283.27872

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=CC=NC=C1)C2=CC=CC=C2C(=O)O

Isomeric SMILES

COC(=O)/C(=C/C1=CC=NC=C1)/C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C16H13NO4/c1-21-16(20)14(10-11-6-8-17-9-7-11)12-4-2-3-5-13(12)15(18)19/h2-10H,1H3,(H,18,19)/b14-10+