bis(azanyl)methylidene-butyl-azanium; 4-methylbenzenesulfonate

Systemtic Name: bis(azanyl)methylidene-butyl-azanium; 4-methylbenzenesulfonate Openeye Name: butyl(diaminomethylene)ammonium; 4-methylbenzenesulfonate CAS Name: butyl(diaminomethylidene)ammonium; 4-methylbenzenesulfonate IUPAC Name: butyl(diaminomethylidene)azanium; 4-methylbenzenesulfonate Traditional Name: butyl(diaminomethylene)ammonium tosylate Formula: C12H21N3O3S MolecularWeight: 287.37844

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+]=C(N)N.CC1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CCCC[NH+]=C(N)N.CC1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C7H8O3S.C5H13N3/c1-6-2-4-7(5-3-6)11(8,9)10;1-2-3-4-8-5(6)7/h2-5H,1H3,(H,8,9,10);2-4H2,1H3,(H4,6,7,8)