3-(phenylmethyl)sulfinylpropanoic acid

Systemtic Name: 3-(phenylmethyl)sulfinylpropanoic acid Openeye Name: 3-benzylsulfinylpropanoic acid CAS Name: 3-(phenylmethyl)sulfinylpropanoic acid IUPAC Name: 3-benzylsulfinylpropanoic acid Traditional Name: 3-benzylsulfinylpropionic acid Formula: C10H12O3S MolecularWeight: 212.26548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)CCC(=O)O

InChI

InChI=1S/C10H12O3S/c11-10(12)6-7-14(13)8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,11,12)