5-[4,5-dimethoxy-2-methyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]-5-phenyl-pentanoic acid

Systemtic Name: 5-[4,5-dimethoxy-2-methyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]-5-phenyl-pentanoic acid Openeye Name: 5-(4,5-dimethoxy-2-methyl-3,6-dioxo-cyclohexa-1,4-dien-1-yl)-5-phenyl-pentanoic acid CAS Name: 5-(4,5-dimethoxy-2-methyl-3,6-dioxo-1-cyclohexa-1,4-dienyl)-5-phenylpentanoic acid IUPAC Name: 5-(4,5-dimethoxy-2-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl)-5-phenylpentanoic acid Traditional Name: 5-(3,6-diketo-4,5-dimethoxy-2-methyl-cyclohexa-1,4-dien-1-yl)-5-phenyl-valeric acid Formula: C20H22O6 MolecularWeight: 358.38508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=C(C1=O)OC)OC)C(CCCC(=O)O)C2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=O)C(=C(C1=O)OC)OC)C(CCCC(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C20H22O6/c1-12-16(18(24)20(26-3)19(25-2)17(12)23)14(10-7-11-15(21)22)13-8-5-4-6-9-13/h4-6,8-9,14H,7,10-11H2,1-3H3,(H,21,22)