[3-(2-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-4-yl]methyl-(oxan-4-yl)azanium

Systemtic Name: [3-(2-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-4-yl]methyl-(oxan-4-yl)azanium Openeye Name: [3-(2-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-4-yl]methyl-tetrahydropyran-4-yl-ammonium CAS Name: [3-(2-chlorophenyl)-1-(4-methoxyphenyl)-4-pyrazolyl]methyl-(4-oxanyl)ammonium IUPAC Name: [3-(2-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-4-yl]methyl-(oxan-4-yl)azanium Traditional Name: [3-(2-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-4-yl]methyl-tetrahydropyran-4-yl-ammonium Formula: C22H25ClN3O2+ MolecularWeight: 398.9058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CC=C3Cl)C[NH2+]C4CCOCC4

Isomeric SMILES

COC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CC=C3Cl)C[NH2+]C4CCOCC4

InChI

InChI=1S/C22H24ClN3O2/c1-27-19-8-6-18(7-9-19)26-15-16(14-24-17-10-12-28-13-11-17)22(25-26)20-4-2-3-5-21(20)23/h2-9,15,17,24H,10-14H2,1H3/p+1