[2-methyl-3-[1-oxidanyl-3,4-bis(oxidanylidene)naphthalen-2-yl]propyl] benzoate

Systemtic Name: [2-methyl-3-[1-oxidanyl-3,4-bis(oxidanylidene)naphthalen-2-yl]propyl] benzoate Openeye Name: [3-(1-hydroxy-3,4-dioxo-2-naphthyl)-2-methyl-propyl] benzoate CAS Name: benzoic acid [3-(1-hydroxy-3,4-dioxo-2-naphthalenyl)-2-methylpropyl] ester IUPAC Name: [3-(1-hydroxy-3,4-dioxonaphthalen-2-yl)-2-methylpropyl] benzoate Traditional Name: benzoic acid [3-(1-hydroxy-3,4-diketo-2-naphthyl)-2-methyl-propyl] ester Formula: C21H18O5 MolecularWeight: 350.36462

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C(C2=CC=CC=C2C(=O)C1=O)O)COC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(CC1=C(C2=CC=CC=C2C(=O)C1=O)O)COC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H18O5/c1-13(12-26-21(25)14-7-3-2-4-8-14)11-17-18(22)15-9-5-6-10-16(15)19(23)20(17)24/h2-10,13,22H,11-12H2,1H3