ethyl 1-[2-oxidanylidene-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-oxidanylidene-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl]piperidine-4-carboxylate CAS Name: 1-[2-oxo-2-[3-(1-pyrrolidinylsulfonyl)anilino]ethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl]piperidine-4-carboxylate Traditional Name: 1-[2-keto-2-(3-pyrrolidinosulfonylanilino)ethyl]isonipecotic acid ethyl ester Formula: C20H29N3O5S MolecularWeight: 423.52636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H29N3O5S/c1-2-28-20(25)16-8-12-22(13-9-16)15-19(24)21-17-6-5-7-18(14-17)29(26,27)23-10-3-4-11-23/h5-7,14,16H,2-4,8-13,15H2,1H3,(H,21,24)