2-(2-chlorophenyl)-N-methyl-4-(4-methylphenyl)sulfonyl-N-(1-methylpiperidin-1-ium-4-yl)-1,3-oxazol-5-amine

Systemtic Name: 2-(2-chlorophenyl)-N-methyl-4-(4-methylphenyl)sulfonyl-N-(1-methylpiperidin-1-ium-4-yl)-1,3-oxazol-5-amine Openeye Name: 2-(2-chlorophenyl)-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)-4-(p-tolylsulfonyl)oxazol-5-amine CAS Name: 2-(2-chlorophenyl)-N-methyl-4-(4-methylphenyl)sulfonyl-N-(1-methyl-4-piperidin-1-iumyl)-5-oxazolamine IUPAC Name: 2-(2-chlorophenyl)-N-methyl-4-(4-methylphenyl)sulfonyl-N-(1-methylpiperidin-1-ium-4-yl)-1,3-oxazol-5-amine Traditional Name: [2-(2-chlorophenyl)-4-tosyl-oxazol-5-yl]-methyl-(1-methylpiperidin-1-ium-4-yl)amine Formula: C23H27ClN3O3S+ MolecularWeight: 460.99678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(OC(=N2)C3=CC=CC=C3Cl)N(C)C4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(OC(=N2)C3=CC=CC=C3Cl)N(C)C4CC[NH+](CC4)C

InChI

InChI=1S/C23H26ClN3O3S/c1-16-8-10-18(11-9-16)31(28,29)22-23(27(3)17-12-14-26(2)15-13-17)30-21(25-22)19-6-4-5-7-20(19)24/h4-11,17H,12-15H2,1-3H3/p+1