8-phenyl-8-[2,4,5-trimethyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]octanoic acid

Systemtic Name: 8-phenyl-8-[2,4,5-trimethyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]octanoic acid Openeye Name: 8-phenyl-8-(2,4,5-trimethyl-3,6-dioxo-cyclohexa-1,4-dien-1-yl)octanoic acid CAS Name: 8-phenyl-8-(2,4,5-trimethyl-3,6-dioxo-1-cyclohexa-1,4-dienyl)octanoic acid IUPAC Name: 8-phenyl-8-(2,4,5-trimethyl-3,6-dioxocyclohexa-1,4-dien-1-yl)octanoic acid Traditional Name: 8-(3,6-diketo-2,4,5-trimethyl-cyclohexa-1,4-dien-1-yl)-8-phenyl-caprylic acid Formula: C23H28O4 MolecularWeight: 368.46602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28O4/c1-15-16(2)23(27)21(17(3)22(15)26)19(18-11-7-6-8-12-18)13-9-4-5-10-14-20(24)25/h6-8,11-12,19H,4-5,9-10,13-14H2,1-3H3,(H,24,25)