[(2S)-2-(3,4-dimethoxyphenyl)-2-(4-methylphenyl)sulfonyl-ethyl]azanium

Systemtic Name: [(2S)-2-(3,4-dimethoxyphenyl)-2-(4-methylphenyl)sulfonyl-ethyl]azanium Openeye Name: [(2S)-2-(3,4-dimethoxyphenyl)-2-(p-tolylsulfonyl)ethyl]ammonium CAS Name: [(2S)-2-(3,4-dimethoxyphenyl)-2-(4-methylphenyl)sulfonylethyl]ammonium IUPAC Name: [(2S)-2-(3,4-dimethoxyphenyl)-2-(4-methylphenyl)sulfonylethyl]azanium Traditional Name: [(2S)-2-(3,4-dimethoxyphenyl)-2-tosyl-ethyl]ammonium Formula: C17H22NO4S+ MolecularWeight: 336.42588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(C[NH3+])C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[C@H](C[NH3+])C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C17H21NO4S/c1-12-4-7-14(8-5-12)23(19,20)17(11-18)13-6-9-15(21-2)16(10-13)22-3/h4-10,17H,11,18H2,1-3H3/p+1/t17-/m1/s1