(E)-azanyl-[[2-(3-methylphenyl)sulfonyloxyphenyl]methylidene]-(2-phenylethanoyl)azanium

Systemtic Name: (E)-azanyl-[[2-(3-methylphenyl)sulfonyloxyphenyl]methylidene]-(2-phenylethanoyl)azanium Openeye Name: (E)-amino-[[2-(m-tolylsulfonyloxy)phenyl]methylene]-(2-phenylacetyl)ammonium CAS Name: (E)-amino-[[2-(3-methylphenyl)sulfonyloxyphenyl]methylidene]-(1-oxo-2-phenylethyl)ammonium IUPAC Name: (E)-amino-[[2-(3-methylphenyl)sulfonyloxyphenyl]methylidene]-(2-phenylacetyl)azanium Traditional Name: (E)-amino-[2-(m-tolylsulfonyloxy)benzylidene]-(2-phenylacetyl)ammonium Formula: C22H21N2O4S+ MolecularWeight: 409.47814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)OC2=CC=CC=C2C=[N+](C(=O)CC3=CC=CC=C3)N

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)OC2=CC=CC=C2/C=[N+](\C(=O)CC3=CC=CC=C3)/N

InChI

InChI=1S/C22H21N2O4S/c1-17-8-7-12-20(14-17)29(26,27)28-21-13-6-5-11-19(21)16-24(23)22(25)15-18-9-3-2-4-10-18/h2-14,16H,15,23H2,1H3/q+1/b24-16+