1-adamantyl-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]azanium

Systemtic Name: 1-adamantyl-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]azanium Openeye Name: 1-adamantyl-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]ammonium CAS Name: 1-adamantyl-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]ammonium IUPAC Name: 1-adamantyl-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]azanium Traditional Name: 1-adamantyl-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]ammonium Formula: C20H25ClN3+ MolecularWeight: 342.8856

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=C(NN=C4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=C(NN=C4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C20H24ClN3/c21-18-3-1-16(2-4-18)19-17(12-23-24-19)11-22-20-8-13-5-14(9-20)7-15(6-13)10-20/h1-4,12-15,22H,5-11H2,(H,23,24)/p+1