1-adamantyl-[[3-[(1-phenyl-1,2,3,4-tetrazol-5-yl)oxy]phenyl]methyl]azanium

Systemtic Name: 1-adamantyl-[[3-[(1-phenyl-1,2,3,4-tetrazol-5-yl)oxy]phenyl]methyl]azanium Openeye Name: 1-adamantyl-[[3-(1-phenyltetrazol-5-yl)oxyphenyl]methyl]ammonium CAS Name: 1-adamantyl-[[3-[(1-phenyl-5-tetrazolyl)oxy]phenyl]methyl]ammonium IUPAC Name: 1-adamantyl-[[3-(1-phenyltetrazol-5-yl)oxyphenyl]methyl]azanium Traditional Name: 1-adamantyl-[3-(1-phenyltetrazol-5-yl)oxybenzyl]ammonium Formula: C24H28N5O+ MolecularWeight: 402.51202

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=CC(=CC=C4)OC5=NN=NN5C6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=CC(=CC=C4)OC5=NN=NN5C6=CC=CC=C6

InChI

InChI=1S/C24H27N5O/c1-2-6-21(7-3-1)29-23(26-27-28-29)30-22-8-4-5-17(12-22)16-25-24-13-18-9-19(14-24)11-20(10-18)15-24/h1-8,12,18-20,25H,9-11,13-16H2/p+1