[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl] 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: [2-(1H-indol-3-yl)-2-oxidanylidene-ethyl] 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Openeye Name: [2-(1H-indol-3-yl)-2-oxo-ethyl] 1-(2-thienylsulfonyl)piperidine-4-carboxylate CAS Name: 1-thiophen-2-ylsulfonyl-4-piperidinecarboxylic acid [2-(1H-indol-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(1H-indol-3-yl)-2-oxoethyl] 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-thienylsulfonyl)isonipecotic acid [2-(1H-indol-3-yl)-2-keto-ethyl] ester Formula: C20H20N2O5S2 MolecularWeight: 432.5132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC(=O)C2=CNC3=CC=CC=C32)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1C(=O)OCC(=O)C2=CNC3=CC=CC=C32)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C20H20N2O5S2/c23-18(16-12-21-17-5-2-1-4-15(16)17)13-27-20(24)14-7-9-22(10-8-14)29(25,26)19-6-3-11-28-19/h1-6,11-12,14,21H,7-10,13H2