(2-oxidanylidene-2-piperidin-1-yl-ethyl) 5-nitro-1-benzothiophene-2-carboxylate

Systemtic Name: (2-oxidanylidene-2-piperidin-1-yl-ethyl) 5-nitro-1-benzothiophene-2-carboxylate Openeye Name: [2-oxo-2-(1-piperidyl)ethyl] 5-nitrobenzothiophene-2-carboxylate CAS Name: 5-nitro-1-benzothiophene-2-carboxylic acid [2-oxo-2-(1-piperidinyl)ethyl] ester IUPAC Name: (2-oxo-2-piperidin-1-ylethyl) 5-nitro-1-benzothiophene-2-carboxylate Traditional Name: 5-nitrobenzothiophene-2-carboxylic acid (2-keto-2-piperidino-ethyl) ester Formula: C16H16N2O5S MolecularWeight: 348.37364

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)COC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)COC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O5S/c19-15(17-6-2-1-3-7-17)10-23-16(20)14-9-11-8-12(18(21)22)4-5-13(11)24-14/h4-5,8-9H,1-3,6-7,10H2