2-[5-ethoxycarbonyl-6-methyl-2-oxidanylidene-1-(phenylmethyl)-3,4-dihydropyridin-3-yl]ethanoic acid

Systemtic Name: 2-[5-ethoxycarbonyl-6-methyl-2-oxidanylidene-1-(phenylmethyl)-3,4-dihydropyridin-3-yl]ethanoic acid Openeye Name: 2-(1-benzyl-5-ethoxycarbonyl-6-methyl-2-oxo-3,4-dihydropyridin-3-yl)acetic acid CAS Name: 2-[5-ethoxycarbonyl-6-methyl-2-oxo-1-(phenylmethyl)-3,4-dihydropyridin-3-yl]acetic acid IUPAC Name: 2-(1-benzyl-5-ethoxycarbonyl-6-methyl-2-oxo-3,4-dihydropyridin-3-yl)acetic acid Traditional Name: 2-(1-benzyl-5-carbethoxy-2-keto-6-methyl-3,4-dihydropyridin-3-yl)acetic acid Formula: C18H21NO5 MolecularWeight: 331.36304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)C(C1)CC(=O)O)CC2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)C(C1)CC(=O)O)CC2=CC=CC=C2)C

InChI

InChI=1S/C18H21NO5/c1-3-24-18(23)15-9-14(10-16(20)21)17(22)19(12(15)2)11-13-7-5-4-6-8-13/h4-8,14H,3,9-11H2,1-2H3,(H,20,21)