3-(6-oxidanylidene-1-phenethyl-2,3-dihydropyridin-5-yl)propanoic acid

Systemtic Name: 3-(6-oxidanylidene-1-phenethyl-2,3-dihydropyridin-5-yl)propanoic acid Openeye Name: 3-(6-oxo-1-phenethyl-2,3-dihydropyridin-5-yl)propanoic acid CAS Name: 3-(6-oxo-1-phenethyl-2,3-dihydropyridin-5-yl)propanoic acid IUPAC Name: 3-(6-oxo-1-phenethyl-2,3-dihydropyridin-5-yl)propanoic acid Traditional Name: 3-(6-keto-1-phenethyl-2,3-dihydropyridin-5-yl)propionic acid Formula: C16H19NO3 MolecularWeight: 273.32696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C(=C1)CCC(=O)O)CCC2=CC=CC=C2

Isomeric SMILES

C1CN(C(=O)C(=C1)CCC(=O)O)CCC2=CC=CC=C2

InChI

InChI=1S/C16H19NO3/c18-15(19)9-8-14-7-4-11-17(16(14)20)12-10-13-5-2-1-3-6-13/h1-3,5-7H,4,8-12H2,(H,18,19)