ethyl 1-[3-oxidanylidene-3-[(4-sulfamoylphenyl)amino]propyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[3-oxidanylidene-3-[(4-sulfamoylphenyl)amino]propyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[3-oxo-3-(4-sulfamoylanilino)propyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[3-oxo-3-(4-sulfamoylanilino)propyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-oxo-3-(4-sulfamoylanilino)propyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[3-keto-3-(4-sulfamoylanilino)propyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C17H26N3O5S+ MolecularWeight: 384.47044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C17H25N3O5S/c1-2-25-17(22)13-7-10-20(11-8-13)12-9-16(21)19-14-3-5-15(6-4-14)26(18,23)24/h3-6,13H,2,7-12H2,1H3,(H,19,21)(H2,18,23,24)/p+1