cyclopropyl-[2-(2,5-dimethylphenyl)sulfonylethyl]-[(4-methoxyphenyl)methyl]azanium

Systemtic Name: cyclopropyl-[2-(2,5-dimethylphenyl)sulfonylethyl]-[(4-methoxyphenyl)methyl]azanium Openeye Name: cyclopropyl-[2-(2,5-dimethylphenyl)sulfonylethyl]-[(4-methoxyphenyl)methyl]ammonium CAS Name: cyclopropyl-[2-(2,5-dimethylphenyl)sulfonylethyl]-[(4-methoxyphenyl)methyl]ammonium IUPAC Name: cyclopropyl-[2-(2,5-dimethylphenyl)sulfonylethyl]-[(4-methoxyphenyl)methyl]azanium Traditional Name: cyclopropyl-[2-(2,5-dimethylphenyl)sulfonylethyl]-p-anisyl-ammonium Formula: C21H28NO3S+ MolecularWeight: 374.51692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)CC[NH+](CC2=CC=C(C=C2)OC)C3CC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)CC[NH+](CC2=CC=C(C=C2)OC)C3CC3

InChI

InChI=1S/C21H27NO3S/c1-16-4-5-17(2)21(14-16)26(23,24)13-12-22(19-8-9-19)15-18-6-10-20(25-3)11-7-18/h4-7,10-11,14,19H,8-9,12-13,15H2,1-3H3/p+1