1-(1-adamantyl)-3,4-diphenyl-1,2,4-triazol-4-ium

Systemtic Name: 1-(1-adamantyl)-3,4-diphenyl-1,2,4-triazol-4-ium Openeye Name: 1-(1-adamantyl)-3,4-diphenyl-1,2,4-triazol-4-ium CAS Name: 1-(1-adamantyl)-3,4-diphenyl-1,2,4-triazol-4-ium IUPAC Name: 1-(1-adamantyl)-3,4-diphenyl-1,2,4-triazol-4-ium Traditional Name: 1-(1-adamantyl)-3,4-diphenyl-1,2,4-triazol-4-ium Formula: C24H26N3+ MolecularWeight: 356.48334

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N4C=[N+](C(=N4)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N4C=[N+](C(=N4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C24H26N3/c1-3-7-21(8-4-1)23-25-27(17-26(23)22-9-5-2-6-10-22)24-14-18-11-19(15-24)13-20(12-18)16-24/h1-10,17-20H,11-16H2/q+1