N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-methylsulfonyl-benzamide

Systemtic Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-methylsulfonyl-benzamide Openeye Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-methylsulfonyl-benzamide CAS Name: N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]-3-methylsulfonylbenzamide IUPAC Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-methylsulfonylbenzamide Traditional Name: 3-mesyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide Formula: C19H24N3O3S+ MolecularWeight: 374.47716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O3S/c1-21-10-12-22(13-11-21)17-8-6-16(7-9-17)20-19(23)15-4-3-5-18(14-15)26(2,24)25/h3-9,14H,10-13H2,1-2H3,(H,20,23)/p+1