dimethyl-(2-phenyl-3H-isoindol-1-ylidene)azanium; 4-methylbenzenesulfonate

Systemtic Name: dimethyl-(2-phenyl-3H-isoindol-1-ylidene)azanium; 4-methylbenzenesulfonate Openeye Name: dimethyl-(2-phenylisoindolin-1-ylidene)ammonium; 4-methylbenzenesulfonate CAS Name: dimethyl-(2-phenyl-3H-isoindol-1-ylidene)ammonium; 4-methylbenzenesulfonate IUPAC Name: dimethyl-(2-phenyl-3H-isoindol-1-ylidene)azanium; 4-methylbenzenesulfonate Traditional Name: dimethyl-(2-phenylisoindolin-1-ylidene)ammonium tosylate Formula: C23H24N2O3S MolecularWeight: 408.51326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+](=C1C2=CC=CC=C2CN1C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+](=C1C2=CC=CC=C2CN1C3=CC=CC=C3)C

InChI

InChI=1S/C16H17N2.C7H8O3S/c1-17(2)16-15-11-7-6-8-13(15)12-18(16)14-9-4-3-5-10-14;1-6-2-4-7(5-3-6)11(8,9)10/h3-11H,12H2,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1