2-[2,6-bis(oxidanyl)-4-pentyl-3,5-bis(phenylmethyl)phenyl]-4-ethyl-6-methyl-cyclohexene-1-carboxylic acid

Systemtic Name: 2-[2,6-bis(oxidanyl)-4-pentyl-3,5-bis(phenylmethyl)phenyl]-4-ethyl-6-methyl-cyclohexene-1-carboxylic acid Openeye Name: 2-(3,5-dibenzyl-2,6-dihydroxy-4-pentyl-phenyl)-4-ethyl-6-methyl-cyclohexene-1-carboxylic acid CAS Name: 2-[2,6-dihydroxy-4-pentyl-3,5-bis(phenylmethyl)phenyl]-4-ethyl-6-methyl-1-cyclohexenecarboxylic acid IUPAC Name: 2-(3,5-dibenzyl-2,6-dihydroxy-4-pentylphenyl)-4-ethyl-6-methylcyclohexene-1-carboxylic acid Traditional Name: 2-(4-amyl-3,5-dibenzyl-2,6-dihydroxy-phenyl)-4-ethyl-6-methyl-cyclohexene-1-carboxylic acid Formula: C35H42O4 MolecularWeight: 526.70558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(C(=C1CC2=CC=CC=C2)O)C3=C(C(CC(C3)CC)C)C(=O)O)O)CC4=CC=CC=C4

Isomeric SMILES

CCCCCC1=C(C(=C(C(=C1CC2=CC=CC=C2)O)C3=C(C(CC(C3)CC)C)C(=O)O)O)CC4=CC=CC=C4

InChI

InChI=1S/C35H42O4/c1-4-6-9-18-27-28(21-25-14-10-7-11-15-25)33(36)32(34(37)29(27)22-26-16-12-8-13-17-26)30-20-24(5-2)19-23(3)31(30)35(38)39/h7-8,10-17,23-24,36-37H,4-6,9,18-22H2,1-3H3,(H,38,39)