5-[3-[3-methyl-4-(2,3,3-trimethyl-2-oxidanyl-butoxy)phenyl]pentan-3-yl]thiophene-2-carboxylic acid

Systemtic Name: 5-[3-[3-methyl-4-(2,3,3-trimethyl-2-oxidanyl-butoxy)phenyl]pentan-3-yl]thiophene-2-carboxylic acid Openeye Name: 5-[1-ethyl-1-[4-(2-hydroxy-2,3,3-trimethyl-butoxy)-3-methyl-phenyl]propyl]thiophene-2-carboxylic acid CAS Name: 5-[3-[4-(2-hydroxy-2,3,3-trimethylbutoxy)-3-methylphenyl]pentan-3-yl]-2-thiophenecarboxylic acid IUPAC Name: 5-[3-[4-(2-hydroxy-2,3,3-trimethylbutoxy)-3-methylphenyl]pentan-3-yl]thiophene-2-carboxylic acid Traditional Name: 5-[1-ethyl-1-[4-(2-hydroxy-2,3,3-trimethyl-butoxy)-3-methyl-phenyl]propyl]-2-thenoic acid Formula: C24H34O4S MolecularWeight: 418.58936

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CC(=C(C=C1)OCC(C)(C(C)(C)C)O)C)C2=CC=C(S2)C(=O)O

Isomeric SMILES

CCC(CC)(C1=CC(=C(C=C1)OCC(C)(C(C)(C)C)O)C)C2=CC=C(S2)C(=O)O

InChI

InChI=1S/C24H34O4S/c1-8-24(9-2,20-13-12-19(29-20)21(25)26)17-10-11-18(16(3)14-17)28-15-23(7,27)22(4,5)6/h10-14,27H,8-9,15H2,1-7H3,(H,25,26)