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

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: (2-amino-2-oxo-ethyl) 4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: 4,5,6,7-tetrahydrobenzothiophene-2-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=C(S2)C(=O)OCC(=O)N

Isomeric SMILES

C1CCC2=C(C1)C=C(S2)C(=O)OCC(=O)N

InChI

InChI=1S/C11H13NO3S/c12-10(13)6-15-11(14)9-5-7-3-1-2-4-8(7)16-9/h5H,1-4,6H2,(H2,12,13)