(E)-azanyl-(2-phenylethanoyl)-[[2-(4-propylphenyl)sulfonyloxyphenyl]methylidene]azanium

Systemtic Name: (E)-azanyl-(2-phenylethanoyl)-[[2-(4-propylphenyl)sulfonyloxyphenyl]methylidene]azanium Openeye Name: (E)-amino-(2-phenylacetyl)-[[2-(4-propylphenyl)sulfonyloxyphenyl]methylene]ammonium CAS Name: (E)-amino-(1-oxo-2-phenylethyl)-[[2-(4-propylphenyl)sulfonyloxyphenyl]methylidene]ammonium IUPAC Name: (E)-amino-(2-phenylacetyl)-[[2-(4-propylphenyl)sulfonyloxyphenyl]methylidene]azanium Traditional Name: (E)-amino-(2-phenylacetyl)-[2-(4-propylphenyl)sulfonyloxybenzylidene]ammonium Formula: C24H25N2O4S+ MolecularWeight: 437.5313

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C=[N+](C(=O)CC3=CC=CC=C3)N

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2/C=[N+](\C(=O)CC3=CC=CC=C3)/N

InChI

InChI=1S/C24H25N2O4S/c1-2-8-19-13-15-22(16-14-19)31(28,29)30-23-12-7-6-11-21(23)18-26(25)24(27)17-20-9-4-3-5-10-20/h3-7,9-16,18H,2,8,17,25H2,1H3/q+1/b26-18+