3-[3-[(2-chlorophenyl)amino]-3-oxidanylidene-propyl]sulfanylpropanoic acid

Systemtic Name: 3-[3-[(2-chlorophenyl)amino]-3-oxidanylidene-propyl]sulfanylpropanoic acid Openeye Name: 3-[3-(2-chloroanilino)-3-oxo-propyl]sulfanylpropanoic acid CAS Name: 3-[[3-(2-chloroanilino)-3-oxopropyl]thio]propanoic acid IUPAC Name: 3-[3-(2-chloroanilino)-3-oxopropyl]sulfanylpropanoic acid Traditional Name: 3-[[3-(2-chloroanilino)-3-keto-propyl]thio]propionic acid Formula: C12H14ClNO3S MolecularWeight: 287.76246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CCSCCC(=O)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CCSCCC(=O)O)Cl

InChI

InChI=1S/C12H14ClNO3S/c13-9-3-1-2-4-10(9)14-11(15)5-7-18-8-6-12(16)17/h1-4H,5-8H2,(H,14,15)(H,16,17)