phenacyl 1-ethyl-7-methyl-4-oxidanylidene-3H-1,8-naphthyridin-1-ium-2-carboxylate

Systemtic Name: phenacyl 1-ethyl-7-methyl-4-oxidanylidene-3H-1,8-naphthyridin-1-ium-2-carboxylate Openeye Name: phenacyl 1-ethyl-7-methyl-4-oxo-3H-1,8-naphthyridin-1-ium-2-carboxylate CAS Name: 1-ethyl-7-methyl-4-oxo-3H-1,8-naphthyridin-1-ium-2-carboxylic acid phenacyl ester IUPAC Name: phenacyl 1-ethyl-7-methyl-4-oxo-3H-1,8-naphthyridin-1-ium-2-carboxylate Traditional Name: 1-ethyl-4-keto-7-methyl-3H-1,8-naphthyridin-1-ium-2-carboxylic acid phenacyl ester Formula: C20H19N2O4+ MolecularWeight: 351.37586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(CC(=O)C2=C1N=C(C=C2)C)C(=O)OCC(=O)C3=CC=CC=C3

Isomeric SMILES

CC[N+]1=C(CC(=O)C2=C1N=C(C=C2)C)C(=O)OCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H19N2O4/c1-3-22-16(11-17(23)15-10-9-13(2)21-19(15)22)20(25)26-12-18(24)14-7-5-4-6-8-14/h4-10H,3,11-12H2,1-2H3/q+1