1-[4-[(4-methoxyphenyl)methyl]-1H-pyrazol-5-yl]-6,11-dihydrobenzo[b]quinolizin-5-ium-9-ol perchlorate

Systemtic Name: 1-[4-[(4-methoxyphenyl)methyl]-1H-pyrazol-5-yl]-6,11-dihydrobenzo[b]quinolizin-5-ium-9-ol perchlorate Openeye Name: 1-[4-[(4-methoxyphenyl)methyl]-1H-pyrazol-5-yl]-6,11-dihydrobenzo[b]quinolizin-5-ium-9-ol perchlorate CAS Name: 1-[4-[(4-methoxyphenyl)methyl]-1H-pyrazol-5-yl]-6,11-dihydrobenzo[b]quinolizin-5-ium-9-ol perchlorate IUPAC Name: 1-[4-[(4-methoxyphenyl)methyl]-1H-pyrazol-5-yl]-6,11-dihydrobenzo[b]quinolizin-5-ium-9-ol perchlorate Traditional Name: 1-(4-p-anisyl-1H-pyrazol-5-yl)-6,11-dihydrobenzo[b]quinolizin-5-ium-9-ol perchlorate Formula: C24H22ClN3O6 MolecularWeight: 483.90098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=C(NN=C2)C3=C4CC5=C(C[N+]4=CC=C3)C=CC(=C5)O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

COC1=CC=C(C=C1)CC2=C(NN=C2)C3=C4CC5=C(C[N+]4=CC=C3)C=CC(=C5)O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C24H21N3O2.ClHO4/c1-29-21-8-4-16(5-9-21)11-19-14-25-26-24(19)22-3-2-10-27-15-17-6-7-20(28)12-18(17)13-23(22)27;2-1(3,4)5/h2-10,12,14H,11,13,15H2,1H3,(H-,25,26,28);(H,2,3,4,5)