7-[2-(4-tert-butylphenyl)ethylsulfonyl]heptanoic acid

Systemtic Name: 7-[2-(4-tert-butylphenyl)ethylsulfonyl]heptanoic acid Openeye Name: 7-[2-(4-tert-butylphenyl)ethylsulfonyl]heptanoic acid CAS Name: 7-[2-(4-tert-butylphenyl)ethylsulfonyl]heptanoic acid IUPAC Name: 7-[2-(4-tert-butylphenyl)ethylsulfonyl]heptanoic acid Traditional Name: 7-[2-(4-tert-butylphenyl)ethylsulfonyl]enanthic acid Formula: C19H30O4S MolecularWeight: 354.5041

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CCS(=O)(=O)CCCCCCC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CCS(=O)(=O)CCCCCCC(=O)O

InChI

InChI=1S/C19H30O4S/c1-19(2,3)17-11-9-16(10-12-17)13-15-24(22,23)14-7-5-4-6-8-18(20)21/h9-12H,4-8,13-15H2,1-3H3,(H,20,21)