4-(2,5-dimethylpyrrol-1-yl)-N'-oxidanyl-benzenecarboximidamide

Systemtic Name: 4-(2,5-dimethylpyrrol-1-yl)-N'-oxidanyl-benzenecarboximidamide Openeye Name: 4-(2,5-dimethylpyrrol-1-yl)-N'-hydroxy-benzamidine CAS Name: 4-(2,5-dimethyl-1-pyrrolyl)-N'-hydroxybenzenecarboximidamide IUPAC Name: 4-(2,5-dimethylpyrrol-1-yl)-N'-hydroxybenzenecarboximidamide Traditional Name: 4-(2,5-dimethylpyrrol-1-yl)-N'-hydroxy-benzamidine Formula: C13H15N3O MolecularWeight: 229.2777

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=NO)N)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)/C(=N/O)/N)C

InChI

InChI=1S/C13H15N3O/c1-9-3-4-10(2)16(9)12-7-5-11(6-8-12)13(14)15-17/h3-8,17H,1-2H3,(H2,14,15)