3-[(4-methylphenyl)methylsulfonyl]-N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]propanamide

Systemtic Name: 3-[(4-methylphenyl)methylsulfonyl]-N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]propanamide Openeye Name: N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-3-(p-tolylmethylsulfonyl)propanamide CAS Name: 3-[(4-methylphenyl)methylsulfonyl]-N-[3-(4-methyl-1-piperazine-1,4-diiumyl)propyl]propanamide IUPAC Name: 3-[(4-methylphenyl)methylsulfonyl]-N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]propanamide Traditional Name: 3-(4-methylbenzyl)sulfonyl-N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]propionamide Formula: C19H33N3O3S+2 MolecularWeight: 383.54862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CS(=O)(=O)CCC(=O)NCCC[NH+]2CC[NH+](CC2)C

Isomeric SMILES

CC1=CC=C(C=C1)CS(=O)(=O)CCC(=O)NCCC[NH+]2CC[NH+](CC2)C

InChI

InChI=1S/C19H31N3O3S/c1-17-4-6-18(7-5-17)16-26(24,25)15-8-19(23)20-9-3-10-22-13-11-21(2)12-14-22/h4-7H,3,8-16H2,1-2H3,(H,20,23)/p+2