2-(4-methoxyphenyl)sulfonyl-2-propyl-pentanoic acid

Systemtic Name: 2-(4-methoxyphenyl)sulfonyl-2-propyl-pentanoic acid Openeye Name: 2-(4-methoxyphenyl)sulfonyl-2-propyl-pentanoic acid CAS Name: 2-(4-methoxyphenyl)sulfonyl-2-propylpentanoic acid IUPAC Name: 2-(4-methoxyphenyl)sulfonyl-2-propylpentanoic acid Traditional Name: 2-(4-methoxyphenyl)sulfonyl-2-propyl-valeric acid Formula: C15H22O5S MolecularWeight: 314.39718

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)(C(=O)O)S(=O)(=O)C1=CC=C(C=C1)OC

Isomeric SMILES

CCCC(CCC)(C(=O)O)S(=O)(=O)C1=CC=C(C=C1)OC

InChI

InChI=1S/C15H22O5S/c1-4-10-15(11-5-2,14(16)17)21(18,19)13-8-6-12(20-3)7-9-13/h6-9H,4-5,10-11H2,1-3H3,(H,16,17)