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

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: (2-amino-2-oxo-ethyl) 4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid (2-amino-2-keto-ethyl) ester Formula: C11H13NO3S MolecularWeight: 239.29082

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=CS2)C(=O)OCC(=O)N

Isomeric SMILES

C1CCC2=C(C1)C(=CS2)C(=O)OCC(=O)N

InChI

InChI=1S/C11H13NO3S/c12-10(13)5-15-11(14)8-6-16-9-4-2-1-3-7(8)9/h6H,1-5H2,(H2,12,13)