5-[5-[3-(2,5-dimethylphenyl)propyl]thiophen-2-yl]-3,3-dimethyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[5-[3-(2,5-dimethylphenyl)propyl]thiophen-2-yl]-3,3-dimethyl-5-oxidanylidene-pentanoic acid Openeye Name: 5-[5-[3-(2,5-dimethylphenyl)propyl]-2-thienyl]-3,3-dimethyl-5-oxo-pentanoic acid CAS Name: 5-[5-[3-(2,5-dimethylphenyl)propyl]-2-thiophenyl]-3,3-dimethyl-5-oxopentanoic acid IUPAC Name: 5-[5-[3-(2,5-dimethylphenyl)propyl]thiophen-2-yl]-3,3-dimethyl-5-oxopentanoic acid Traditional Name: 5-[5-[3-(2,5-dimethylphenyl)propyl]-2-thienyl]-5-keto-3,3-dimethyl-valeric acid Formula: C22H28O3S MolecularWeight: 372.52092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CCCC2=CC=C(S2)C(=O)CC(C)(C)CC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)CCCC2=CC=C(S2)C(=O)CC(C)(C)CC(=O)O

InChI

InChI=1S/C22H28O3S/c1-15-8-9-16(2)17(12-15)6-5-7-18-10-11-20(26-18)19(23)13-22(3,4)14-21(24)25/h8-12H,5-7,13-14H2,1-4H3,(H,24,25)