(4-oxidanylcyclohexyl)-[(1-phenylpyrazol-4-yl)methyl]azanium

Systemtic Name: (4-oxidanylcyclohexyl)-[(1-phenylpyrazol-4-yl)methyl]azanium Openeye Name: (4-hydroxycyclohexyl)-[(1-phenylpyrazol-4-yl)methyl]ammonium CAS Name: (4-hydroxycyclohexyl)-[(1-phenyl-4-pyrazolyl)methyl]ammonium IUPAC Name: (4-hydroxycyclohexyl)-[(1-phenylpyrazol-4-yl)methyl]azanium Traditional Name: (4-hydroxycyclohexyl)-[(1-phenylpyrazol-4-yl)methyl]ammonium Formula: C16H22N3O+ MolecularWeight: 272.36538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1[NH2+]CC2=CN(N=C2)C3=CC=CC=C3)O

Isomeric SMILES

C1CC(CCC1[NH2+]CC2=CN(N=C2)C3=CC=CC=C3)O

InChI

InChI=1S/C16H21N3O/c20-16-8-6-14(7-9-16)17-10-13-11-18-19(12-13)15-4-2-1-3-5-15/h1-5,11-12,14,16-17,20H,6-10H2/p+1