2-azanyl-3-[3,4-bis(oxidanyl)phenyl]sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-[3,4-bis(oxidanyl)phenyl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-(3,4-dihydroxyphenyl)sulfanyl-propanoic acid CAS Name: 2-amino-3-[(3,4-dihydroxyphenyl)thio]propanoic acid IUPAC Name: 2-amino-3-(3,4-dihydroxyphenyl)sulfanylpropanoic acid Traditional Name: 2-amino-3-[(3,4-dihydroxyphenyl)thio]propionic acid Formula: C9H11NO4S MolecularWeight: 229.25294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1SCC(C(=O)O)N)O)O

Isomeric SMILES

C1=CC(=C(C=C1SCC(C(=O)O)N)O)O

InChI

InChI=1S/C9H11NO4S/c10-6(9(13)14)4-15-5-1-2-7(11)8(12)3-5/h1-3,6,11-12H,4,10H2,(H,13,14)