[2-[(2-chloranylpyridin-3-yl)amino]-2-oxidanylidene-ethyl] (2E,4E)-hexa-2,4-dienoate

Systemtic Name: [2-[(2-chloranylpyridin-3-yl)amino]-2-oxidanylidene-ethyl] (2E,4E)-hexa-2,4-dienoate Openeye Name: [2-[(2-chloro-3-pyridyl)amino]-2-oxo-ethyl] (2E,4E)-hexa-2,4-dienoate CAS Name: (2E,4E)-hexa-2,4-dienoic acid [2-[(2-chloro-3-pyridinyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-chloropyridin-3-yl)amino]-2-oxoethyl] (2E,4E)-hexa-2,4-dienoate Traditional Name: (2E,4E)-hexa-2,4-dienoic acid [2-[(2-chloro-3-pyridyl)amino]-2-keto-ethyl] ester Formula: C13H13ClN2O3 MolecularWeight: 280.70692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)OCC(=O)NC1=C(N=CC=C1)Cl

Isomeric SMILES

C/C=C/C=C/C(=O)OCC(=O)NC1=C(N=CC=C1)Cl

InChI

InChI=1S/C13H13ClN2O3/c1-2-3-4-7-12(18)19-9-11(17)16-10-6-5-8-15-13(10)14/h2-8H,9H2,1H3,(H,16,17)/b3-2+,7-4+