2-(cyclohexen-1-yl)ethyl-[(1-phenylpyrazol-4-yl)methyl]azanium

Systemtic Name: 2-(cyclohexen-1-yl)ethyl-[(1-phenylpyrazol-4-yl)methyl]azanium Openeye Name: 2-(cyclohexen-1-yl)ethyl-[(1-phenylpyrazol-4-yl)methyl]ammonium CAS Name: 2-(1-cyclohexenyl)ethyl-[(1-phenyl-4-pyrazolyl)methyl]ammonium IUPAC Name: 2-(cyclohexen-1-yl)ethyl-[(1-phenylpyrazol-4-yl)methyl]azanium Traditional Name: 2-(cyclohexen-1-yl)ethyl-[(1-phenylpyrazol-4-yl)methyl]ammonium Formula: C18H24N3+ MolecularWeight: 282.40326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CC[NH2+]CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

C1CCC(=CC1)CC[NH2+]CC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H23N3/c1-3-7-16(8-4-1)11-12-19-13-17-14-20-21(15-17)18-9-5-2-6-10-18/h2,5-7,9-10,14-15,19H,1,3-4,8,11-13H2/p+1