2-(1-adamantyl)-1-methyl-4H-pyrazolo[1,5-a]indol-1-ium

Systemtic Name: 2-(1-adamantyl)-1-methyl-4H-pyrazolo[1,5-a]indol-1-ium Openeye Name: 2-(1-adamantyl)-1-methyl-4H-pyrazolo[1,5-a]indol-1-ium CAS Name: 2-(1-adamantyl)-1-methyl-4H-pyrazolo[1,5-a]indol-1-ium IUPAC Name: 2-(1-adamantyl)-1-methyl-4H-pyrazolo[1,5-a]indol-1-ium Traditional Name: 2-(1-adamantyl)-1-methyl-4H-pyrazol[1,5-a]indol-1-ium Formula: C21H25N2+ MolecularWeight: 305.4366

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C=C2N1C3=CC=CC=C3C2)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C[N+]1=C(C=C2N1C3=CC=CC=C3C2)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C21H25N2/c1-22-20(10-18-9-17-4-2-3-5-19(17)23(18)22)21-11-14-6-15(12-21)8-16(7-14)13-21/h2-5,10,14-16H,6-9,11-13H2,1H3/q+1