ethyl 2-(trichloromethyloxycarbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-(trichloromethyloxycarbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-(trichloromethoxycarbonylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[oxo(trichloromethoxy)methyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(trichloromethoxycarbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-(trichloromethoxycarbonylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C13H14Cl3NO4S MolecularWeight: 386.67856

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)OC(Cl)(Cl)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)OC(Cl)(Cl)Cl

InChI

InChI=1S/C13H14Cl3NO4S/c1-2-20-11(18)9-7-5-3-4-6-8(7)22-10(9)17-12(19)21-13(14,15)16/h2-6H2,1H3,(H,17,19)