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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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