N3-phenethyl-2-phenyl-pyridazin-2-ium-3,5-diamine perchlorate

Systemtic Name: N3-phenethyl-2-phenyl-pyridazin-2-ium-3,5-diamine perchlorate Openeye Name: N3-phenethyl-2-phenyl-pyridazin-2-ium-3,5-diamine perchlorate CAS Name: N3-phenethyl-2-phenylpyridazin-2-ium-3,5-diamine perchlorate IUPAC Name: 3-N-phenethyl-2-phenylpyridazin-2-ium-3,5-diamine perchlorate Traditional Name: (5-amino-2-phenyl-pyridazin-2-ium-3-yl)-phenethyl-amine perchlorate Formula: C18H19ClN4O4 MolecularWeight: 390.82086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=[N+](N=CC(=C2)N)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=[N+](N=CC(=C2)N)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C18H18N4.ClHO4/c19-16-13-18(20-12-11-15-7-3-1-4-8-15)22(21-14-16)17-9-5-2-6-10-17;2-1(3,4)5/h1-10,13-14H,11-12H2,(H2,19,20);(H,2,3,4,5)