N-[(3-bromanyl-4,5-dimethoxy-phenyl)methyl]-1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-amine

Systemtic Name: N-[(3-bromanyl-4,5-dimethoxy-phenyl)methyl]-1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-amine Openeye Name: N-[(3-bromo-4,5-dimethoxy-phenyl)methyl]-1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-amine CAS Name: N-[(3-bromo-4,5-dimethoxyphenyl)methyl]-1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-amine IUPAC Name: N-[(3-bromo-4,5-dimethoxyphenyl)methyl]-1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-amine Traditional Name: (3-bromo-4,5-dimethoxy-benzyl)-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)amine Formula: C10H11BrN5O2- MolecularWeight: 313.13064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNC2=NN=N[N-]2)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)CNC2=NN=N[N-]2)Br)OC

InChI

InChI=1S/C10H11BrN5O2/c1-17-8-4-6(3-7(11)9(8)18-2)5-12-10-13-15-16-14-10/h3-4H,5H2,1-2H3,(H-,12,13,14,15,16)/q-1