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

Systemtic Name: N-[4-(4-methylpiperazin-4-ium-1-yl)carbonylphenyl]-N-(phenylmethyl)methanesulfonamide Openeye Name: N-benzyl-N-[4-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]methanesulfonamide CAS Name: N-[4-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]phenyl]-N-(phenylmethyl)methanesulfonamide IUPAC Name: N-benzyl-N-[4-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]methanesulfonamide Traditional Name: N-benzyl-N-[4-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]methanesulfonamide Formula: C20H26N3O3S+ MolecularWeight: 388.50374

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)N(CC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)N(CC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C20H25N3O3S/c1-21-12-14-22(15-13-21)20(24)18-8-10-19(11-9-18)23(27(2,25)26)16-17-6-4-3-5-7-17/h3-11H,12-16H2,1-2H3/p+1