(4-methylpiperazin-4-ium-1-yl)-(2-propylsulfonylphenyl)methanone

Systemtic Name: (4-methylpiperazin-4-ium-1-yl)-(2-propylsulfonylphenyl)methanone Openeye Name: (4-methylpiperazin-4-ium-1-yl)-(2-propylsulfonylphenyl)methanone CAS Name: (4-methyl-1-piperazin-4-iumyl)-(2-propylsulfonylphenyl)methanone IUPAC Name: (4-methylpiperazin-4-ium-1-yl)-(2-propylsulfonylphenyl)methanone Traditional Name: (4-methylpiperazin-4-ium-1-yl)-(2-propylsulfonylphenyl)methanone Formula: C15H23N2O3S+ MolecularWeight: 311.41972

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=CC=CC=C1C(=O)N2CC[NH+](CC2)C

Isomeric SMILES

CCCS(=O)(=O)C1=CC=CC=C1C(=O)N2CC[NH+](CC2)C

InChI

InChI=1S/C15H22N2O3S/c1-3-12-21(19,20)14-7-5-4-6-13(14)15(18)17-10-8-16(2)9-11-17/h4-7H,3,8-12H2,1-2H3/p+1