methyl 3-[[(E)-3-[4-(pyridin-2-ylmethoxy)phenyl]prop-2-enoyl]amino]benzoate

Systemtic Name: methyl 3-[[(E)-3-[4-(pyridin-2-ylmethoxy)phenyl]prop-2-enoyl]amino]benzoate Openeye Name: methyl 3-[[(E)-3-[4-(2-pyridylmethoxy)phenyl]prop-2-enoyl]amino]benzoate CAS Name: 3-[[(E)-1-oxo-3-[4-(2-pyridinylmethoxy)phenyl]prop-2-enyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[(E)-3-[4-(pyridin-2-ylmethoxy)phenyl]prop-2-enoyl]amino]benzoate Traditional Name: 3-[[(E)-3-[4-(2-pyridylmethoxy)phenyl]acryloyl]amino]benzoic acid methyl ester Formula: C23H20N2O4 MolecularWeight: 388.4159

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)C=CC2=CC=C(C=C2)OCC3=CC=CC=N3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)/C=C/C2=CC=C(C=C2)OCC3=CC=CC=N3

InChI

InChI=1S/C23H20N2O4/c1-28-23(27)18-5-4-7-19(15-18)25-22(26)13-10-17-8-11-21(12-9-17)29-16-20-6-2-3-14-24-20/h2-15H,16H2,1H3,(H,25,26)/b13-10+