5-(4-methoxyphenyl)-2-sulfinyl-pentanoic acid

Systemtic Name: 5-(4-methoxyphenyl)-2-sulfinyl-pentanoic acid Openeye Name: 5-(4-methoxyphenyl)-2-sulfinyl-pentanoic acid CAS Name: 5-(4-methoxyphenyl)-2-sulfinylpentanoic acid IUPAC Name: 5-(4-methoxyphenyl)-2-sulfinylpentanoic acid Traditional Name: 5-(4-methoxyphenyl)-2-sulfinyl-valeric acid Formula: C12H14O4S MolecularWeight: 254.30216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCCC(=S=O)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CCCC(=S=O)C(=O)O

InChI

InChI=1S/C12H14O4S/c1-16-10-7-5-9(6-8-10)3-2-4-11(17-15)12(13)14/h5-8H,2-4H2,1H3,(H,13,14)