1-methyl-4-(4-methylnaphthalen-1-yl)sulfonyl-piperazin-1-ium

Systemtic Name: 1-methyl-4-(4-methylnaphthalen-1-yl)sulfonyl-piperazin-1-ium Openeye Name: 1-methyl-4-[(4-methyl-1-naphthyl)sulfonyl]piperazin-1-ium CAS Name: 1-methyl-4-[(4-methyl-1-naphthalenyl)sulfonyl]piperazin-1-ium IUPAC Name: 1-methyl-4-(4-methylnaphthalen-1-yl)sulfonylpiperazin-1-ium Traditional Name: 1-methyl-4-[(4-methyl-1-naphthyl)sulfonyl]piperazin-1-ium Formula: C16H21N2O2S+ MolecularWeight: 305.41514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C2=CC=CC=C12)S(=O)(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=C(C2=CC=CC=C12)S(=O)(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C16H20N2O2S/c1-13-7-8-16(15-6-4-3-5-14(13)15)21(19,20)18-11-9-17(2)10-12-18/h3-8H,9-12H2,1-2H3/p+1