N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-4-(4-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-4-(4-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-4-[(4-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-[3-(4-methyl-1-piperidin-1-iumyl)propyl]-4-[(4-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-4-(4-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-4-(4-methylpiperidino)sulfonyl-benzamide Formula: C22H36N3O3S+ MolecularWeight: 422.60454

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCCNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C

Isomeric SMILES

CC1CC[NH+](CC1)CCCNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C

InChI

InChI=1S/C22H35N3O3S/c1-18-8-14-24(15-9-18)13-3-12-23-22(26)20-4-6-21(7-5-20)29(27,28)25-16-10-19(2)11-17-25/h4-7,18-19H,3,8-17H2,1-2H3,(H,23,26)/p+1