(2-oxidanylidene-2-phenylazanyl-ethyl) 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Openeye Name: (2-anilino-2-oxo-ethyl) 1-(2-thienylsulfonyl)piperidine-4-carboxylate CAS Name: 1-thiophen-2-ylsulfonyl-4-piperidinecarboxylic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-thienylsulfonyl)isonipecotic acid (2-anilino-2-keto-ethyl) ester Formula: C18H20N2O5S2 MolecularWeight: 408.4918

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC(=O)NC2=CC=CC=C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCC1C(=O)OCC(=O)NC2=CC=CC=C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H20N2O5S2/c21-16(19-15-5-2-1-3-6-15)13-25-18(22)14-8-10-20(11-9-14)27(23,24)17-7-4-12-26-17/h1-7,12,14H,8-11,13H2,(H,19,21)