2-[5,7-dimethoxy-3,4-bis(oxidanylidene)naphthalen-2-yl]ethyl benzoate

Systemtic Name: 2-[5,7-dimethoxy-3,4-bis(oxidanylidene)naphthalen-2-yl]ethyl benzoate Openeye Name: 2-(5,7-dimethoxy-3,4-dioxo-2-naphthyl)ethyl benzoate CAS Name: benzoic acid 2-(5,7-dimethoxy-3,4-dioxo-2-naphthalenyl)ethyl ester IUPAC Name: 2-(5,7-dimethoxy-3,4-dioxonaphthalen-2-yl)ethyl benzoate Traditional Name: benzoic acid 2-(3,4-diketo-5,7-dimethoxy-2-naphthyl)ethyl ester Formula: C21H18O6 MolecularWeight: 366.36402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)C=C(C(=O)C2=O)CCOC(=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=C2C(=C1)C=C(C(=O)C2=O)CCOC(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C21H18O6/c1-25-16-11-15-10-14(19(22)20(23)18(15)17(12-16)26-2)8-9-27-21(24)13-6-4-3-5-7-13/h3-7,10-12H,8-9H2,1-2H3