5,7-dimethyl-1-phenyl-2,3-dihydropyrazolo[1,5-a]pyrimidin-8-ium perchlorate

Systemtic Name: 5,7-dimethyl-1-phenyl-2,3-dihydropyrazolo[1,5-a]pyrimidin-8-ium perchlorate Openeye Name: 5,7-dimethyl-1-phenyl-2,3-dihydropyrazolo[1,5-a]pyrimidin-8-ium perchlorate CAS Name: 5,7-dimethyl-1-phenyl-2,3-dihydropyrazolo[1,5-a]pyrimidin-8-ium perchlorate IUPAC Name: 5,7-dimethyl-1-phenyl-2,3-dihydropyrazolo[1,5-a]pyrimidin-8-ium perchlorate Traditional Name: 5,7-dimethyl-1-phenyl-2,3-dihydropyrazolo[1,5-a]pyrimidin-8-ium perchlorate Formula: C14H16ClN3O4 MolecularWeight: 325.74754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+]2C(=N1)CCN2C3=CC=CC=C3)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC(=[N+]2C(=N1)CCN2C3=CC=CC=C3)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C14H16N3.ClHO4/c1-11-10-12(2)17-14(15-11)8-9-16(17)13-6-4-3-5-7-13;2-1(3,4)5/h3-7,10H,8-9H2,1-2H3;(H,2,3,4,5)/q+1;/p-1