2-[4-[[2-[(2-chlorophenyl)methylsulfanyl]ethanoylamino]azaniumylidenemethyl]phenoxy]ethanoate

Systemtic Name: 2-[4-[[2-[(2-chlorophenyl)methylsulfanyl]ethanoylamino]azaniumylidenemethyl]phenoxy]ethanoate Openeye Name: 2-[4-[[[2-[(2-chlorophenyl)methylsulfanyl]acetyl]amino]iminiomethyl]phenoxy]acetate CAS Name: 2-[4-[[[2-[(2-chlorophenyl)methylthio]-1-oxoethyl]amino]iminiomethyl]phenoxy]acetate IUPAC Name: 2-[4-[[[2-[(2-chlorophenyl)methylsulfanyl]acetyl]amino]azaniumylidenemethyl]phenoxy]acetate Traditional Name: 2-[4-[[[2-[(2-chlorobenzyl)thio]acetyl]amino]iminiomethyl]phenoxy]acetate Formula: C18H17ClN2O4S MolecularWeight: 392.85658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCC(=O)N[NH+]=CC2=CC=C(C=C2)OCC(=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)CSCC(=O)N[NH+]=CC2=CC=C(C=C2)OCC(=O)[O-])Cl

InChI

InChI=1S/C18H17ClN2O4S/c19-16-4-2-1-3-14(16)11-26-12-17(22)21-20-9-13-5-7-15(8-6-13)25-10-18(23)24/h1-9H,10-12H2,(H,21,22)(H,23,24)