4-(piperidin-1-ium-1-ylmethyl)-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]benzamide

Systemtic Name: 4-(piperidin-1-ium-1-ylmethyl)-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]benzamide Openeye Name: 4-(piperidin-1-ium-1-ylmethyl)-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]benzamide CAS Name: 4-(1-piperidin-1-iumylmethyl)-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]benzamide IUPAC Name: 4-(piperidin-1-ium-1-ylmethyl)-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]benzamide Traditional Name: 4-(piperidin-1-ium-1-ylmethyl)-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]benzamide Formula: C21H28N3O3S+ MolecularWeight: 402.53032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)N)NC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)S(=O)(=O)N)NC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3

InChI

InChI=1S/C21H27N3O3S/c1-16(18-9-11-20(12-10-18)28(22,26)27)23-21(25)19-7-5-17(6-8-19)15-24-13-3-2-4-14-24/h5-12,16H,2-4,13-15H2,1H3,(H,23,25)(H2,22,26,27)/p+1/t16-/m0/s1