methyl 3-[1,4-bis(oxidanyl)naphthalen-2-yl]-7-oxidanylidene-cycloheptene-1-carboxylate

Systemtic Name: methyl 3-[1,4-bis(oxidanyl)naphthalen-2-yl]-7-oxidanylidene-cycloheptene-1-carboxylate Openeye Name: methyl 3-(1,4-dihydroxy-2-naphthyl)-7-oxo-cycloheptene-1-carboxylate CAS Name: 3-(1,4-dihydroxy-2-naphthalenyl)-7-oxo-1-cycloheptenecarboxylic acid methyl ester IUPAC Name: methyl 3-(1,4-dihydroxynaphthalen-2-yl)-7-oxocycloheptene-1-carboxylate Traditional Name: 3-(1,4-dihydroxy-2-naphthyl)-7-keto-cycloheptene-1-carboxylic acid methyl ester Formula: C19H18O5 MolecularWeight: 326.34322

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(CCCC1=O)C2=C(C3=CC=CC=C3C(=C2)O)O

Isomeric SMILES

COC(=O)C1=CC(CCCC1=O)C2=C(C3=CC=CC=C3C(=C2)O)O

InChI

InChI=1S/C19H18O5/c1-24-19(23)15-9-11(5-4-8-16(15)20)14-10-17(21)12-6-2-3-7-13(12)18(14)22/h2-3,6-7,9-11,21-22H,4-5,8H2,1H3