(2-naphthalen-2-yl-2-oxidanylidene-ethyl) 3,4-dimethoxybenzoate

Systemtic Name: (2-naphthalen-2-yl-2-oxidanylidene-ethyl) 3,4-dimethoxybenzoate Openeye Name: [2-(2-naphthyl)-2-oxo-ethyl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [2-(2-naphthalenyl)-2-oxoethyl] ester IUPAC Name: (2-naphthalen-2-yl-2-oxoethyl) 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [2-keto-2-(2-naphthyl)ethyl] ester Formula: C21H18O5 MolecularWeight: 350.36462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC(=O)C2=CC3=CC=CC=C3C=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC(=O)C2=CC3=CC=CC=C3C=C2)OC

InChI

InChI=1S/C21H18O5/c1-24-19-10-9-17(12-20(19)25-2)21(23)26-13-18(22)16-8-7-14-5-3-4-6-15(14)11-16/h3-12H,13H2,1-2H3