ethyl 1-[2-oxidanylidene-2-[(4-sulfamoylphenyl)methylamino]ethyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-oxidanylidene-2-[(4-sulfamoylphenyl)methylamino]ethyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl]piperidine-3-carboxylate CAS Name: 1-[2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl]piperidine-3-carboxylate Traditional Name: 1-[2-keto-2-[(4-sulfamoylbenzyl)amino]ethyl]nipecotic acid ethyl ester Formula: C17H25N3O5S MolecularWeight: 383.4625

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CCOC(=O)C1CCCN(C1)CC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C17H25N3O5S/c1-2-25-17(22)14-4-3-9-20(11-14)12-16(21)19-10-13-5-7-15(8-6-13)26(18,23)24/h5-8,14H,2-4,9-12H2,1H3,(H,19,21)(H2,18,23,24)