4-methylbenzenesulfonate; 2-[(E)-(1-methylpyrrolidin-2-yl)methylideneamino]-1-oxidanyl-guanidine

Systemtic Name: 4-methylbenzenesulfonate; 2-[(E)-(1-methylpyrrolidin-2-yl)methylideneamino]-1-oxidanyl-guanidine Openeye Name: 1-hydroxy-2-[(E)-(1-methylpyrrolidin-2-yl)methyleneamino]guanidine; 4-methylbenzenesulfonate CAS Name: 1-hydroxy-2-[(E)-(1-methyl-2-pyrrolidinyl)methylideneamino]guanidine; 4-methylbenzenesulfonate IUPAC Name: 1-hydroxy-2-[(E)-(1-methylpyrrolidin-2-yl)methylideneamino]guanidine; 4-methylbenzenesulfonate Traditional Name: 1-hydroxy-2-[(E)-(1-methylpyrrolidin-2-yl)methyleneamino]guanidine tosylate Formula: C14H22N5O4S- MolecularWeight: 356.42058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].CN1CCCC1C=NN=C(N)NO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].CN1CCCC1/C=N/N=C(\N)/NO

InChI

InChI=1S/C7H15N5O.C7H8O3S/c1-12-4-2-3-6(12)5-9-10-7(8)11-13;1-6-2-4-7(5-3-6)11(8,9)10/h5-6,13H,2-4H2,1H3,(H3,8,10,11);2-5H,1H3,(H,8,9,10)/p-1/b9-5+;