[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 2,5-bis(chloranyl)benzoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 2,5-bis(chloranyl)benzoate Openeye Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 2,5-dichlorobenzoate CAS Name: 2,5-dichlorobenzoic acid [2-oxo-2-[3-(phenylthio)propylamino]ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 2,5-dichlorobenzoate Traditional Name: 2,5-dichlorobenzoic acid [2-keto-2-[3-(phenylthio)propylamino]ethyl] ester Formula: C18H17Cl2NO3S MolecularWeight: 398.30348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCNC(=O)COC(=O)C2=C(C=CC(=C2)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)SCCCNC(=O)COC(=O)C2=C(C=CC(=C2)Cl)Cl

InChI

InChI=1S/C18H17Cl2NO3S/c19-13-7-8-16(20)15(11-13)18(23)24-12-17(22)21-9-4-10-25-14-5-2-1-3-6-14/h1-3,5-8,11H,4,9-10,12H2,(H,21,22)