4-[2-(4,4-dimethylpentyl)-5,7,7-trimethyl-octoxy]benzoic acid

Systemtic Name: 4-[2-(4,4-dimethylpentyl)-5,7,7-trimethyl-octoxy]benzoic acid Openeye Name: 4-[2-(4,4-dimethylpentyl)-5,7,7-trimethyl-octoxy]benzoic acid CAS Name: 4-[2-(4,4-dimethylpentyl)-5,7,7-trimethyloctoxy]benzoic acid IUPAC Name: 4-[2-(4,4-dimethylpentyl)-5,7,7-trimethyloctoxy]benzoic acid Traditional Name: 4-[2-(4,4-dimethylpentyl)-5,7,7-trimethyl-octoxy]benzoic acid Formula: C25H42O3 MolecularWeight: 390.59918

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(CCCC(C)(C)C)COC1=CC=C(C=C1)C(=O)O)CC(C)(C)C

Isomeric SMILES

CC(CCC(CCCC(C)(C)C)COC1=CC=C(C=C1)C(=O)O)CC(C)(C)C

InChI

InChI=1S/C25H42O3/c1-19(17-25(5,6)7)10-11-20(9-8-16-24(2,3)4)18-28-22-14-12-21(13-15-22)23(26)27/h12-15,19-20H,8-11,16-18H2,1-7H3,(H,26,27)