N-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)carbonylphenyl]methanesulfonamide

Systemtic Name: N-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)carbonylphenyl]methanesulfonamide Openeye Name: N-methyl-N-[4-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]methanesulfonamide CAS Name: N-methyl-N-[4-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]phenyl]methanesulfonamide IUPAC Name: N-methyl-N-[4-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]methanesulfonamide Traditional Name: N-methyl-N-[4-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]methanesulfonamide Formula: C14H22N3O3S+ MolecularWeight: 312.40778

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)N(C)S(=O)(=O)C

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)N(C)S(=O)(=O)C

InChI

InChI=1S/C14H21N3O3S/c1-15-8-10-17(11-9-15)14(18)12-4-6-13(7-5-12)16(2)21(3,19)20/h4-7H,8-11H2,1-3H3/p+1