(E)-[bis(azanyl)methylideneamino]-(2-methoxy-2-oxidanylidene-ethylidene)azanium; methanesulfonate

Systemtic Name: (E)-[bis(azanyl)methylideneamino]-(2-methoxy-2-oxidanylidene-ethylidene)azanium; methanesulfonate Openeye Name: (E)-guanidino-(2-methoxy-2-oxo-ethylidene)ammonium; methanesulfonate CAS Name: (E)-(diaminomethylideneamino)-(2-methoxy-2-oxoethylidene)ammonium; methanesulfonate IUPAC Name: (E)-(diaminomethylideneamino)-(2-methoxy-2-oxoethylidene)azanium; methanesulfonate Traditional Name: (E)-guanidino-(2-keto-2-methoxy-ethylidene)ammonium mesylate Formula: C5H12N4O5S MolecularWeight: 240.23758

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=[NH+]N=C(N)N.CS(=O)(=O)[O-]

Isomeric SMILES

COC(=O)/C=[NH+]/N=C(N)N.CS(=O)(=O)[O-]

InChI

InChI=1S/C4H8N4O2.CH4O3S/c1-10-3(9)2-7-8-4(5)6;1-5(2,3)4/h2H,1H3,(H4,5,6,8);1H3,(H,2,3,4)/b7-2+;