[2-oxidanylidene-2-(quinolin-5-ylamino)ethyl] 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(quinolin-5-ylamino)ethyl] 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate Openeye Name: [2-oxo-2-(5-quinolylamino)ethyl] 1-(3-pyridylsulfonyl)piperidine-4-carboxylate CAS Name: 1-(3-pyridinylsulfonyl)-4-piperidinecarboxylic acid [2-oxo-2-(5-quinolinylamino)ethyl] ester IUPAC Name: [2-oxo-2-(quinolin-5-ylamino)ethyl] 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(3-pyridylsulfonyl)isonipecotic acid [2-keto-2-(5-quinolylamino)ethyl] ester Formula: C22H22N4O5S MolecularWeight: 454.49888

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC(=O)NC2=CC=CC3=C2C=CC=N3)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)OCC(=O)NC2=CC=CC3=C2C=CC=N3)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C22H22N4O5S/c27-21(25-20-7-1-6-19-18(20)5-3-11-24-19)15-31-22(28)16-8-12-26(13-9-16)32(29,30)17-4-2-10-23-14-17/h1-7,10-11,14,16H,8-9,12-13,15H2,(H,25,27)