S-[2,2,2-tris(chloranyl)-1-(ethoxycarbonylamino)ethyl] benzenecarbothioate

Systemtic Name: S-[2,2,2-tris(chloranyl)-1-(ethoxycarbonylamino)ethyl] benzenecarbothioate Openeye Name: S-[2,2,2-trichloro-1-(ethoxycarbonylamino)ethyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[2,2,2-trichloro-1-(ethoxycarbonylamino)ethyl] ester IUPAC Name: S-[2,2,2-trichloro-1-(ethoxycarbonylamino)ethyl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[1-(carbethoxyamino)-2,2,2-trichloro-ethyl] ester Formula: C12H12Cl3NO3S MolecularWeight: 356.65258

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(C(Cl)(Cl)Cl)SC(=O)C1=CC=CC=C1

Isomeric SMILES

CCOC(=O)NC(C(Cl)(Cl)Cl)SC(=O)C1=CC=CC=C1

InChI

InChI=1S/C12H12Cl3NO3S/c1-2-19-11(18)16-10(12(13,14)15)20-9(17)8-6-4-3-5-7-8/h3-7,10H,2H2,1H3,(H,16,18)