[3-(3-fluorophenyl)-1-(3-methylphenyl)pyrazol-4-yl]methyl-(4-oxidanylcyclohexyl)azanium

Systemtic Name: [3-(3-fluorophenyl)-1-(3-methylphenyl)pyrazol-4-yl]methyl-(4-oxidanylcyclohexyl)azanium Openeye Name: [3-(3-fluorophenyl)-1-(m-tolyl)pyrazol-4-yl]methyl-(4-hydroxycyclohexyl)ammonium CAS Name: [3-(3-fluorophenyl)-1-(3-methylphenyl)-4-pyrazolyl]methyl-(4-hydroxycyclohexyl)ammonium IUPAC Name: [3-(3-fluorophenyl)-1-(3-methylphenyl)pyrazol-4-yl]methyl-(4-hydroxycyclohexyl)azanium Traditional Name: [3-(3-fluorophenyl)-1-(m-tolyl)pyrazol-4-yl]methyl-(4-hydroxycyclohexyl)ammonium Formula: C23H27FN3O+ MolecularWeight: 380.478383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=C(C(=N2)C3=CC(=CC=C3)F)C[NH2+]C4CCC(CC4)O

Isomeric SMILES

CC1=CC(=CC=C1)N2C=C(C(=N2)C3=CC(=CC=C3)F)C[NH2+]C4CCC(CC4)O

InChI

InChI=1S/C23H26FN3O/c1-16-4-2-7-21(12-16)27-15-18(14-25-20-8-10-22(28)11-9-20)23(26-27)17-5-3-6-19(24)13-17/h2-7,12-13,15,20,22,25,28H,8-11,14H2,1H3/p+1