4-[4,5-dimethoxy-2-methyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]-3,4-dihydro-2H-chromene-2-carboxylic acid

Systemtic Name: 4-[4,5-dimethoxy-2-methyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]-3,4-dihydro-2H-chromene-2-carboxylic acid Openeye Name: 4-(4,5-dimethoxy-2-methyl-3,6-dioxo-cyclohexa-1,4-dien-1-yl)chromane-2-carboxylic acid CAS Name: 4-(4,5-dimethoxy-2-methyl-3,6-dioxo-1-cyclohexa-1,4-dienyl)-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid IUPAC Name: 4-(4,5-dimethoxy-2-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl)-3,4-dihydro-2H-chromene-2-carboxylic acid Traditional Name: 4-(3,6-diketo-4,5-dimethoxy-2-methyl-cyclohexa-1,4-dien-1-yl)chroman-2-carboxylic acid Formula: C19H18O7 MolecularWeight: 358.34202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=C(C1=O)OC)OC)C2CC(OC3=CC=CC=C23)C(=O)O

Isomeric SMILES

CC1=C(C(=O)C(=C(C1=O)OC)OC)C2CC(OC3=CC=CC=C23)C(=O)O

InChI

InChI=1S/C19H18O7/c1-9-14(16(21)18(25-3)17(24-2)15(9)20)11-8-13(19(22)23)26-12-7-5-4-6-10(11)12/h4-7,11,13H,8H2,1-3H3,(H,22,23)