[2-(3,4-dichlorophenyl)-2-oxidanylidene-ethyl] 2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylbenzoate

Systemtic Name: [2-(3,4-dichlorophenyl)-2-oxidanylidene-ethyl] 2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylbenzoate Openeye Name: [2-(3,4-dichlorophenyl)-2-oxo-ethyl] 2-(2-amino-2-oxo-ethyl)sulfanylbenzoate CAS Name: 2-[(2-amino-2-oxoethyl)thio]benzoic acid [2-(3,4-dichlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dichlorophenyl)-2-oxoethyl] 2-(2-amino-2-oxoethyl)sulfanylbenzoate Traditional Name: 2-[(2-amino-2-keto-ethyl)thio]benzoic acid [2-(3,4-dichlorophenyl)-2-keto-ethyl] ester Formula: C17H13Cl2NO4S MolecularWeight: 398.26042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OCC(=O)C2=CC(=C(C=C2)Cl)Cl)SCC(=O)N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OCC(=O)C2=CC(=C(C=C2)Cl)Cl)SCC(=O)N

InChI

InChI=1S/C17H13Cl2NO4S/c18-12-6-5-10(7-13(12)19)14(21)8-24-17(23)11-3-1-2-4-15(11)25-9-16(20)22/h1-7H,8-9H2,(H2,20,22)