N-(3,5-dimethylphenyl)-2-(4-methylsulfonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(3,5-dimethylphenyl)-2-(4-methylsulfonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(3,5-dimethylphenyl)-2-(4-methylsulfonylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(3,5-dimethylphenyl)-2-(4-methylsulfonyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(3,5-dimethylphenyl)-2-(4-methylsulfonylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(3,5-dimethylphenyl)-2-(4-mesylpiperazin-1-ium-1-yl)acetamide Formula: C15H24N3O3S+ MolecularWeight: 326.43436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C)C

InChI

InChI=1S/C15H23N3O3S/c1-12-8-13(2)10-14(9-12)16-15(19)11-17-4-6-18(7-5-17)22(3,20)21/h8-10H,4-7,11H2,1-3H3,(H,16,19)/p+1