N-[azanyl-[(E)-(oxidanylamino)methylideneamino]methylidene]-3-pyrrol-1-yl-benzamide; methanesulfonate

Systemtic Name: N-[azanyl-[(E)-(oxidanylamino)methylideneamino]methylidene]-3-pyrrol-1-yl-benzamide; methanesulfonate Openeye Name: N-[amino-[(E)-(hydroxyamino)methyleneamino]methylene]-3-pyrrol-1-yl-benzamide; methanesulfonate CAS Name: N-[amino-[(E)-(hydroxyamino)methylideneamino]methylidene]-3-(1-pyrrolyl)benzamide; methanesulfonate IUPAC Name: N-[amino-[(E)-(hydroxyamino)methylideneamino]methylidene]-3-pyrrol-1-ylbenzamide; methanesulfonate Traditional Name: N-[amino-[(E)-(hydroxyamino)methyleneamino]methylene]-3-pyrrol-1-yl-benzamide mesylate Formula: C14H16N5O5S- MolecularWeight: 366.37234

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)[O-].C1=CN(C=C1)C2=CC=CC(=C2)C(=O)N=C(N)N=CNO

Isomeric SMILES

CS(=O)(=O)[O-].C1=CN(C=C1)C2=CC=CC(=C2)C(=O)N=C(N)/N=C/NO

InChI

InChI=1S/C13H13N5O2.CH4O3S/c14-13(15-9-16-20)17-12(19)10-4-3-5-11(8-10)18-6-1-2-7-18;1-5(2,3)4/h1-9,20H,(H3,14,15,16,17,19);1H3,(H,2,3,4)/p-1