2-[2-[2-(3-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-[2-(3-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl]sulfanylethanoic acid Openeye Name: 2-[2-[2-(3-chlorophenyl)ethylamino]-2-oxo-ethyl]sulfanylacetic acid CAS Name: 2-[[2-[2-(3-chlorophenyl)ethylamino]-2-oxoethyl]thio]acetic acid IUPAC Name: 2-[2-[2-(3-chlorophenyl)ethylamino]-2-oxoethyl]sulfanylacetic acid Traditional Name: 2-[[2-[2-(3-chlorophenyl)ethylamino]-2-keto-ethyl]thio]acetic acid Formula: C12H14ClNO3S MolecularWeight: 287.76246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CCNC(=O)CSCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CCNC(=O)CSCC(=O)O

InChI

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