ethyl 1-[2-oxidanylidene-2-[(4-sulfamoylphenyl)amino]ethyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[2-oxidanylidene-2-[(4-sulfamoylphenyl)amino]ethyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[2-oxo-2-(4-sulfamoylanilino)ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[2-oxo-2-(4-sulfamoylanilino)ethyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-oxo-2-(4-sulfamoylanilino)ethyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[2-keto-2-(4-sulfamoylanilino)ethyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C16H24N3O5S+ MolecularWeight: 370.44386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O5S/c1-2-24-16(21)12-7-9-19(10-8-12)11-15(20)18-13-3-5-14(6-4-13)25(17,22)23/h3-6,12H,2,7-11H2,1H3,(H,18,20)(H2,17,22,23)/p+1