3-[1-[(4-acetamidophenyl)methyl]-6-oxidanylidene-2,3-dihydropyridin-5-yl]propanoic acid

Systemtic Name: 3-[1-[(4-acetamidophenyl)methyl]-6-oxidanylidene-2,3-dihydropyridin-5-yl]propanoic acid Openeye Name: 3-[1-[(4-acetamidophenyl)methyl]-6-oxo-2,3-dihydropyridin-5-yl]propanoic acid CAS Name: 3-[1-[(4-acetamidophenyl)methyl]-6-oxo-2,3-dihydropyridin-5-yl]propanoic acid IUPAC Name: 3-[1-[(4-acetamidophenyl)methyl]-6-oxo-2,3-dihydropyridin-5-yl]propanoic acid Traditional Name: 3-[1-(4-acetamidobenzyl)-6-keto-2,3-dihydropyridin-5-yl]propionic acid Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CN2CCC=C(C2=O)CCC(=O)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CN2CCC=C(C2=O)CCC(=O)O

InChI

InChI=1S/C17H20N2O4/c1-12(20)18-15-7-4-13(5-8-15)11-19-10-2-3-14(17(19)23)6-9-16(21)22/h3-5,7-8H,2,6,9-11H2,1H3,(H,18,20)(H,21,22)