2-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: 2-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: 2-[2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]thio]acetate IUPAC Name: 2-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-[(4-chlorobenzyl)amino]-2-keto-ethyl]thio]acetate Formula: C11H11ClNO3S- MolecularWeight: 272.72794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)CSCC(=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)CSCC(=O)[O-])Cl

InChI

InChI=1S/C11H12ClNO3S/c12-9-3-1-8(2-4-9)5-13-10(14)6-17-7-11(15)16/h1-4H,5-7H2,(H,13,14)(H,15,16)/p-1