2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-naphthalen-2-yl-ethanamide

Systemtic Name: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-naphthalen-2-yl-ethanamide Openeye Name: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-naphthyl)acetamide CAS Name: 2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]-N-(2-naphthalenyl)acetamide IUPAC Name: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-naphthalen-2-ylacetamide Traditional Name: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-naphthyl)acetamide Formula: C24H28N3O3S+ MolecularWeight: 438.56242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C24H27N3O3S/c1-18-7-8-19(2)23(15-18)31(29,30)27-13-11-26(12-14-27)17-24(28)25-22-10-9-20-5-3-4-6-21(20)16-22/h3-10,15-16H,11-14,17H2,1-2H3,(H,25,28)/p+1