6-phenyl-6-[2,4,5-trimethyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]hexanoic acid

Systemtic Name: 6-phenyl-6-[2,4,5-trimethyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]hexanoic acid Openeye Name: 6-phenyl-6-(2,4,5-trimethyl-3,6-dioxo-cyclohexa-1,4-dien-1-yl)hexanoic acid CAS Name: 6-phenyl-6-(2,4,5-trimethyl-3,6-dioxo-1-cyclohexa-1,4-dienyl)hexanoic acid IUPAC Name: 6-phenyl-6-(2,4,5-trimethyl-3,6-dioxocyclohexa-1,4-dien-1-yl)hexanoic acid Traditional Name: 6-(3,6-diketo-2,4,5-trimethyl-cyclohexa-1,4-dien-1-yl)-6-phenyl-hexanoic acid Formula: C21H24O4 MolecularWeight: 340.41286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=C(C1=O)C)C(CCCCC(=O)O)C2=CC=CC=C2)C

Isomeric SMILES

CC1=C(C(=O)C(=C(C1=O)C)C(CCCCC(=O)O)C2=CC=CC=C2)C

InChI

InChI=1S/C21H24O4/c1-13-14(2)21(25)19(15(3)20(13)24)17(11-7-8-12-18(22)23)16-9-5-4-6-10-16/h4-6,9-10,17H,7-8,11-12H2,1-3H3,(H,22,23)