4-(dipropylsulfamoyl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzamide

Systemtic Name: 4-(dipropylsulfamoyl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzamide Openeye Name: 4-(dipropylsulfamoyl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzamide CAS Name: 4-(dipropylsulfamoyl)-N-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]benzamide IUPAC Name: 4-(dipropylsulfamoyl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzamide Traditional Name: 4-(dipropylsulfamoyl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzamide Formula: C22H38N3O3S+ MolecularWeight: 424.62042

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)NCCC[NH+]2CCCCC2C

Isomeric SMILES

CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)NCCC[NH+]2CCCC[C@@H]2C

InChI

InChI=1S/C22H37N3O3S/c1-4-15-25(16-5-2)29(27,28)21-12-10-20(11-13-21)22(26)23-14-8-18-24-17-7-6-9-19(24)3/h10-13,19H,4-9,14-18H2,1-3H3,(H,23,26)/p+1/t19-/m0/s1