7-[2,4,5-trimethyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]octanoic acid

Systemtic Name: 7-[2,4,5-trimethyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]octanoic acid Openeye Name: 7-(2,4,5-trimethyl-3,6-dioxo-cyclohexa-1,4-dien-1-yl)octanoic acid CAS Name: 7-(2,4,5-trimethyl-3,6-dioxo-1-cyclohexa-1,4-dienyl)octanoic acid IUPAC Name: 7-(2,4,5-trimethyl-3,6-dioxocyclohexa-1,4-dien-1-yl)octanoic acid Traditional Name: 7-(3,6-diketo-2,4,5-trimethyl-cyclohexa-1,4-dien-1-yl)caprylic acid Formula: C17H24O4 MolecularWeight: 292.37006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=C(C1=O)C)C(C)CCCCCC(=O)O)C

Isomeric SMILES

CC1=C(C(=O)C(=C(C1=O)C)C(C)CCCCCC(=O)O)C

InChI

InChI=1S/C17H24O4/c1-10(8-6-5-7-9-14(18)19)15-13(4)16(20)11(2)12(3)17(15)21/h10H,5-9H2,1-4H3,(H,18,19)