2-[[3,5-bis(chloranyl)-4-sulfanyl-phenyl]amino]ethanoic acid

Systemtic Name: 2-[[3,5-bis(chloranyl)-4-sulfanyl-phenyl]amino]ethanoic acid Openeye Name: 2-(3,5-dichloro-4-sulfanyl-anilino)acetic acid CAS Name: 2-(3,5-dichloro-4-mercaptoanilino)acetic acid IUPAC Name: 2-(3,5-dichloro-4-sulfanylanilino)acetic acid Traditional Name: 2-(3,5-dichloro-4-mercapto-anilino)acetic acid Formula: C8H7Cl2NO2S MolecularWeight: 252.11768

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Cl)S)Cl)NCC(=O)O

Isomeric SMILES

C1=C(C=C(C(=C1Cl)S)Cl)NCC(=O)O

InChI

InChI=1S/C8H7Cl2NO2S/c9-5-1-4(11-3-7(12)13)2-6(10)8(5)14/h1-2,11,14H,3H2,(H,12,13)