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

Systemtic Name: [2,2-dimethyl-3-[1-oxidanyl-3,4-bis(oxidanylidene)naphthalen-2-yl]propyl] benzoate Openeye Name: [3-(1-hydroxy-3,4-dioxo-2-naphthyl)-2,2-dimethyl-propyl] benzoate CAS Name: benzoic acid [3-(1-hydroxy-3,4-dioxo-2-naphthalenyl)-2,2-dimethylpropyl] ester IUPAC Name: [3-(1-hydroxy-3,4-dioxonaphthalen-2-yl)-2,2-dimethylpropyl] benzoate Traditional Name: benzoic acid [3-(1-hydroxy-3,4-diketo-2-naphthyl)-2,2-dimethyl-propyl] ester Formula: C22H20O5 MolecularWeight: 364.3912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20O5/c1-22(2,13-27-21(26)14-8-4-3-5-9-14)12-17-18(23)15-10-6-7-11-16(15)19(24)20(17)25/h3-11,23H,12-13H2,1-2H3