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

Systemtic Name: 3-[5,7-dimethoxy-3,4-bis(oxidanylidene)naphthalen-2-yl]propyl benzoate Openeye Name: 3-(5,7-dimethoxy-3,4-dioxo-2-naphthyl)propyl benzoate CAS Name: benzoic acid 3-(5,7-dimethoxy-3,4-dioxo-2-naphthalenyl)propyl ester IUPAC Name: 3-(5,7-dimethoxy-3,4-dioxonaphthalen-2-yl)propyl benzoate Traditional Name: benzoic acid 3-(3,4-diketo-5,7-dimethoxy-2-naphthyl)propyl ester Formula: C22H20O6 MolecularWeight: 380.3906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20O6/c1-26-17-12-16-11-15(20(23)21(24)19(16)18(13-17)27-2)9-6-10-28-22(25)14-7-4-3-5-8-14/h3-5,7-8,11-13H,6,9-10H2,1-2H3