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

Systemtic Name: 2-[[3,5-bis(chloranyl)-4-sulfanyl-phenyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-(3,5-dichloro-4-sulfanyl-anilino)-3-phenyl-propanoic acid CAS Name: 2-(3,5-dichloro-4-mercaptoanilino)-3-phenylpropanoic acid IUPAC Name: 2-(3,5-dichloro-4-sulfanylanilino)-3-phenylpropanoic acid Traditional Name: 2-(3,5-dichloro-4-mercapto-anilino)-3-phenyl-propionic acid Formula: C15H13Cl2NO2S MolecularWeight: 342.24022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC2=CC(=C(C(=C2)Cl)S)Cl

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC2=CC(=C(C(=C2)Cl)S)Cl

InChI

InChI=1S/C15H13Cl2NO2S/c16-11-7-10(8-12(17)14(11)21)18-13(15(19)20)6-9-4-2-1-3-5-9/h1-5,7-8,13,18,21H,6H2,(H,19,20)