2-phenyl-N3-(phenylmethyl)pyridazin-2-ium-3,5-diamine perchlorate

Systemtic Name: 2-phenyl-N3-(phenylmethyl)pyridazin-2-ium-3,5-diamine perchlorate Openeye Name: N3-benzyl-2-phenyl-pyridazin-2-ium-3,5-diamine perchlorate CAS Name: 2-phenyl-N3-(phenylmethyl)pyridazin-2-ium-3,5-diamine perchlorate IUPAC Name: 3-N-benzyl-2-phenylpyridazin-2-ium-3,5-diamine perchlorate Traditional Name: (5-amino-2-phenyl-pyridazin-2-ium-3-yl)-benzyl-amine perchlorate Formula: C17H17ClN4O4 MolecularWeight: 376.79428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=[N+](N=CC(=C2)N)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)CNC2=[N+](N=CC(=C2)N)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C17H16N4.ClHO4/c18-15-11-17(19-12-14-7-3-1-4-8-14)21(20-13-15)16-9-5-2-6-10-16;2-1(3,4)5/h1-11,13H,12H2,(H2,18,19);(H,2,3,4,5)