1,4-diphenyl-7,8,9,10-tetrahydropyrimido[1,2-b]indazol-1-ium perchlorate

Systemtic Name: 1,4-diphenyl-7,8,9,10-tetrahydropyrimido[1,2-b]indazol-1-ium perchlorate Openeye Name: 1,4-diphenyl-7,8,9,10-tetrahydropyrimido[1,2-b]indazol-1-ium perchlorate CAS Name: 1,4-diphenyl-7,8,9,10-tetrahydropyrimido[1,2-b]indazol-1-ium perchlorate IUPAC Name: 1,4-diphenyl-7,8,9,10-tetrahydropyrimido[1,2-b]indazol-1-ium perchlorate Traditional Name: 1,4-diphenyl-7,8,9,10-tetrahydropyrimid[1,2-b]indazol-1-ium perchlorate Formula: C22H20ClN3O4 MolecularWeight: 425.8649

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NN3C(=CC=[N+](C3=C2C1)C4=CC=CC=C4)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1CCC2=NN3C(=CC=[N+](C3=C2C1)C4=CC=CC=C4)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C22H20N3.ClHO4/c1-3-9-17(10-4-1)21-15-16-24(18-11-5-2-6-12-18)22-19-13-7-8-14-20(19)23-25(21)22;2-1(3,4)5/h1-6,9-12,15-16H,7-8,13-14H2;(H,2,3,4,5)/q+1;/p-1