N-[azanyl-(methoxyamino)methylidene]-3-pyrrol-1-yl-benzamide; methanesulfonate

Systemtic Name: N-[azanyl-(methoxyamino)methylidene]-3-pyrrol-1-yl-benzamide; methanesulfonate Openeye Name: N-[amino-(methoxyamino)methylene]-3-pyrrol-1-yl-benzamide; methanesulfonate CAS Name: N-[amino-(methoxyamino)methylidene]-3-(1-pyrrolyl)benzamide; methanesulfonate IUPAC Name: N-[amino-(methoxyamino)methylidene]-3-pyrrol-1-ylbenzamide; methanesulfonate Traditional Name: N-[amino-(methoxyamino)methylene]-3-pyrrol-1-yl-benzamide mesylate Formula: C14H17N4O5S- MolecularWeight: 353.37358

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Descriptors Computed from Structure

Canonical SMILES:

CONC(=NC(=O)C1=CC(=CC=C1)N2C=CC=C2)N.CS(=O)(=O)[O-]

Isomeric SMILES

CONC(=NC(=O)C1=CC(=CC=C1)N2C=CC=C2)N.CS(=O)(=O)[O-]

InChI

InChI=1S/C13H14N4O2.CH4O3S/c1-19-16-13(14)15-12(18)10-5-4-6-11(9-10)17-7-2-3-8-17;1-5(2,3)4/h2-9H,1H3,(H3,14,15,16,18);1H3,(H,2,3,4)/p-1