3-(4-sulfinophenyl)propanoic acid

Systemtic Name: 3-(4-sulfinophenyl)propanoic acid Openeye Name: 3-(4-sulfinophenyl)propanoic acid CAS Name: 3-(4-sulfinophenyl)propanoic acid IUPAC Name: 3-(4-sulfinophenyl)propanoic acid Traditional Name: 3-(4-sulfinophenyl)propionic acid Formula: C9H10O4S MolecularWeight: 214.2383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)O)S(=O)O

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)O)S(=O)O

InChI

InChI=1S/C9H10O4S/c10-9(11)6-3-7-1-4-8(5-2-7)14(12)13/h1-2,4-5H,3,6H2,(H,10,11)(H,12,13)