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

Systemtic Name: ethyl (3S)-1-[2-oxidanylidene-2-[(4-sulfamoylphenyl)amino]ethyl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[2-oxo-2-(4-sulfamoylanilino)ethyl]piperidine-3-carboxylate CAS Name: (3S)-1-[2-oxo-2-(4-sulfamoylanilino)ethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[2-oxo-2-(4-sulfamoylanilino)ethyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[2-keto-2-(4-sulfamoylanilino)ethyl]nipecotic acid ethyl ester Formula: C16H23N3O5S MolecularWeight: 369.43592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C16H23N3O5S/c1-2-24-16(21)12-4-3-9-19(10-12)11-15(20)18-13-5-7-14(8-6-13)25(17,22)23/h5-8,12H,2-4,9-11H2,1H3,(H,18,20)(H2,17,22,23)/t12-/m0/s1