(Z)-azanyl-[[2-(4-cyanophenyl)sulfonyloxyphenyl]methylidene]-(2-phenylethanoyl)azanium

Systemtic Name: (Z)-azanyl-[[2-(4-cyanophenyl)sulfonyloxyphenyl]methylidene]-(2-phenylethanoyl)azanium Openeye Name: (Z)-amino-[[2-(4-cyanophenyl)sulfonyloxyphenyl]methylene]-(2-phenylacetyl)ammonium CAS Name: (Z)-amino-[[2-(4-cyanophenyl)sulfonyloxyphenyl]methylidene]-(1-oxo-2-phenylethyl)ammonium IUPAC Name: (Z)-amino-[[2-(4-cyanophenyl)sulfonyloxyphenyl]methylidene]-(2-phenylacetyl)azanium Traditional Name: (Z)-amino-[2-(4-cyanophenyl)sulfonyloxybenzylidene]-(2-phenylacetyl)ammonium Formula: C22H18N3O4S+ MolecularWeight: 420.46102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)[N+](=CC2=CC=CC=C2OS(=O)(=O)C3=CC=C(C=C3)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)/[N+](=C/C2=CC=CC=C2OS(=O)(=O)C3=CC=C(C=C3)C#N)/N

InChI

InChI=1S/C22H18N3O4S/c23-15-18-10-12-20(13-11-18)30(27,28)29-21-9-5-4-8-19(21)16-25(24)22(26)14-17-6-2-1-3-7-17/h1-13,16H,14,24H2/q+1/b25-16-