N,N-diethyl-4-[(1,2,5-trimethyl-4-nitro-pyrazol-2-ium-3-yl)diazenyl]aniline perchlorate

Systemtic Name: N,N-diethyl-4-[(1,2,5-trimethyl-4-nitro-pyrazol-2-ium-3-yl)diazenyl]aniline perchlorate Openeye Name: N,N-diethyl-4-(1,2,5-trimethyl-4-nitro-pyrazol-2-ium-3-yl)azo-aniline perchlorate CAS Name: N,N-diethyl-4-[(1,2,5-trimethyl-4-nitro-3-pyrazol-2-iumyl)azo]aniline perchlorate IUPAC Name: N,N-diethyl-4-[(1,2,5-trimethyl-4-nitropyrazol-2-ium-3-yl)diazenyl]aniline perchlorate Traditional Name: diethyl-[4-(1,2,5-trimethyl-4-nitro-pyrazol-2-ium-3-yl)azophenyl]amine perchlorate Formula: C16H23ClN6O6 MolecularWeight: 430.84342

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)N=NC2=[N+](N(C(=C2[N+](=O)[O-])C)C)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)N=NC2=[N+](N(C(=C2[N+](=O)[O-])C)C)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C16H23N6O2.ClHO4/c1-6-21(7-2)14-10-8-13(9-11-14)17-18-16-15(22(23)24)12(3)19(4)20(16)5;2-1(3,4)5/h8-11H,6-7H2,1-5H3;(H,2,3,4,5)/q+1;/p-1