5-[1,4-bis(oxidanylidene)naphthalen-2-yl]-3-tert-butyl-2-oxidanyl-benzoic acid

Systemtic Name: 5-[1,4-bis(oxidanylidene)naphthalen-2-yl]-3-tert-butyl-2-oxidanyl-benzoic acid Openeye Name: 3-tert-butyl-5-(1,4-dioxo-2-naphthyl)-2-hydroxy-benzoic acid CAS Name: 3-tert-butyl-5-(1,4-dioxo-2-naphthalenyl)-2-hydroxybenzoic acid IUPAC Name: 3-tert-butyl-5-(1,4-dioxonaphthalen-2-yl)-2-hydroxybenzoic acid Traditional Name: 3-tert-butyl-5-(1,4-diketo-2-naphthyl)-2-hydroxy-benzoic acid Formula: C21H18O5 MolecularWeight: 350.36462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(=O)O)C2=CC(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(=O)O)C2=CC(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H18O5/c1-21(2,3)16-9-11(8-15(19(16)24)20(25)26)14-10-17(22)12-6-4-5-7-13(12)18(14)23/h4-10,24H,1-3H3,(H,25,26)