methyl 3-[4-[(E)-3-oxidanylidene-3-(pyridin-3-ylmethylamino)prop-1-enyl]phenyl]propanoate

Systemtic Name: methyl 3-[4-[(E)-3-oxidanylidene-3-(pyridin-3-ylmethylamino)prop-1-enyl]phenyl]propanoate Openeye Name: methyl 3-[4-[(E)-3-oxo-3-(3-pyridylmethylamino)prop-1-enyl]phenyl]propanoate CAS Name: 3-[4-[(E)-3-oxo-3-(3-pyridinylmethylamino)prop-1-enyl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[(E)-3-oxo-3-(pyridin-3-ylmethylamino)prop-1-enyl]phenyl]propanoate Traditional Name: 3-[4-[(E)-3-keto-3-(3-pyridylmethylamino)prop-1-enyl]phenyl]propionic acid methyl ester Formula: C19H20N2O3 MolecularWeight: 324.3737

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(C=C1)C=CC(=O)NCC2=CN=CC=C2

Isomeric SMILES

COC(=O)CCC1=CC=C(C=C1)/C=C/C(=O)NCC2=CN=CC=C2

InChI

InChI=1S/C19H20N2O3/c1-24-19(23)11-9-16-6-4-15(5-7-16)8-10-18(22)21-14-17-3-2-12-20-13-17/h2-8,10,12-13H,9,11,14H2,1H3,(H,21,22)/b10-8+