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

Systemtic Name: [2-methyl-3-[1-oxidanyl-3,4-bis(oxidanylidene)naphthalen-2-yl]propyl] 2-oxidanylbenzoate Openeye Name: [3-(1-hydroxy-3,4-dioxo-2-naphthyl)-2-methyl-propyl] 2-hydroxybenzoate CAS Name: 2-hydroxybenzoic acid [3-(1-hydroxy-3,4-dioxo-2-naphthalenyl)-2-methylpropyl] ester IUPAC Name: [3-(1-hydroxy-3,4-dioxonaphthalen-2-yl)-2-methylpropyl] 2-hydroxybenzoate Traditional Name: 2-hydroxybenzoic acid [3-(1-hydroxy-3,4-diketo-2-naphthyl)-2-methyl-propyl] ester Formula: C21H18O6 MolecularWeight: 366.36402

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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=C3O

Isomeric SMILES

CC(CC1=C(C2=CC=CC=C2C(=O)C1=O)O)COC(=O)C3=CC=CC=C3O

InChI

InChI=1S/C21H18O6/c1-12(11-27-21(26)15-8-4-5-9-17(15)22)10-16-18(23)13-6-2-3-7-14(13)19(24)20(16)25/h2-9,12,22-23H,10-11H2,1H3