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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N3O5S/c1-2-25-17(22)13-4-3-10-20(12-13)11-9-16(21)19-14-5-7-15(8-6-14)26(18,23)24/h5-8,13H,2-4,9-12H2,1H3,(H,19,21)(H2,18,23,24)/t13-/m0/s1