[(2R)-2-(1,3-benzodioxol-5-yl)-2-(4-methylphenyl)sulfonyl-ethyl]azanium

Systemtic Name: [(2R)-2-(1,3-benzodioxol-5-yl)-2-(4-methylphenyl)sulfonyl-ethyl]azanium Openeye Name: [(2R)-2-(1,3-benzodioxol-5-yl)-2-(p-tolylsulfonyl)ethyl]ammonium CAS Name: [(2R)-2-(1,3-benzodioxol-5-yl)-2-(4-methylphenyl)sulfonylethyl]ammonium IUPAC Name: [(2R)-2-(1,3-benzodioxol-5-yl)-2-(4-methylphenyl)sulfonylethyl]azanium Traditional Name: [(2R)-2-(1,3-benzodioxol-5-yl)-2-tosyl-ethyl]ammonium Formula: C16H18NO4S+ MolecularWeight: 320.38342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(C[NH3+])C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[C@@H](C[NH3+])C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H17NO4S/c1-11-2-5-13(6-3-11)22(18,19)16(9-17)12-4-7-14-15(8-12)21-10-20-14/h2-8,16H,9-10,17H2,1H3/p+1/t16-/m0/s1