[2-(2,4-dimethylphenyl)-2-oxidanylidene-ethyl] 1,4-bis(oxidanyl)naphthalene-2-carboxylate

Systemtic Name: [2-(2,4-dimethylphenyl)-2-oxidanylidene-ethyl] 1,4-bis(oxidanyl)naphthalene-2-carboxylate Openeye Name: [2-(2,4-dimethylphenyl)-2-oxo-ethyl] 1,4-dihydroxynaphthalene-2-carboxylate CAS Name: 1,4-dihydroxy-2-naphthalenecarboxylic acid [2-(2,4-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dimethylphenyl)-2-oxoethyl] 1,4-dihydroxynaphthalene-2-carboxylate Traditional Name: 1,4-dihydroxynaphthalene-2-carboxylic acid [2-(2,4-dimethylphenyl)-2-keto-ethyl] ester Formula: C21H18O5 MolecularWeight: 350.36462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)COC(=O)C2=C(C3=CC=CC=C3C(=C2)O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)COC(=O)C2=C(C3=CC=CC=C3C(=C2)O)O)C

InChI

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