3-azanyl-4-phenoxy-5-sulfanyl-benzoic acid

Systemtic Name: 3-azanyl-4-phenoxy-5-sulfanyl-benzoic acid Openeye Name: 3-amino-4-phenoxy-5-sulfanyl-benzoic acid CAS Name: 3-amino-5-mercapto-4-phenoxybenzoic acid IUPAC Name: 3-amino-4-phenoxy-5-sulfanylbenzoic acid Traditional Name: 3-amino-5-mercapto-4-phenoxy-benzoic acid Formula: C13H11NO3S MolecularWeight: 261.29634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C=C(C=C2S)C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C=C(C=C2S)C(=O)O)N

InChI

InChI=1S/C13H11NO3S/c14-10-6-8(13(15)16)7-11(18)12(10)17-9-4-2-1-3-5-9/h1-7,18H,14H2,(H,15,16)