2-methyl-4-[3-[3-methyl-4-(2,3,3-trimethyl-2-oxidanyl-butoxy)phenyl]pentan-3-yl]benzoic acid

Systemtic Name: 2-methyl-4-[3-[3-methyl-4-(2,3,3-trimethyl-2-oxidanyl-butoxy)phenyl]pentan-3-yl]benzoic acid Openeye Name: 4-[1-ethyl-1-[4-(2-hydroxy-2,3,3-trimethyl-butoxy)-3-methyl-phenyl]propyl]-2-methyl-benzoic acid CAS Name: 4-[3-[4-(2-hydroxy-2,3,3-trimethylbutoxy)-3-methylphenyl]pentan-3-yl]-2-methylbenzoic acid IUPAC Name: 4-[3-[4-(2-hydroxy-2,3,3-trimethylbutoxy)-3-methylphenyl]pentan-3-yl]-2-methylbenzoic acid Traditional Name: 4-[1-ethyl-1-[4-(2-hydroxy-2,3,3-trimethyl-butoxy)-3-methyl-phenyl]propyl]-2-methyl-benzoic acid Formula: C27H38O4 MolecularWeight: 426.58822

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CC(=C(C=C1)C(=O)O)C)C2=CC(=C(C=C2)OCC(C)(C(C)(C)C)O)C

Isomeric SMILES

CCC(CC)(C1=CC(=C(C=C1)C(=O)O)C)C2=CC(=C(C=C2)OCC(C)(C(C)(C)C)O)C

InChI

InChI=1S/C27H38O4/c1-9-27(10-2,20-11-13-22(24(28)29)18(3)15-20)21-12-14-23(19(4)16-21)31-17-26(8,30)25(5,6)7/h11-16,30H,9-10,17H2,1-8H3,(H,28,29)