[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl-[[3-(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]azanium

Systemtic Name: [1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl-[[3-(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]azanium Openeye Name: [1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl-[[3-(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]ammonium CAS Name: [1-(2-methoxyethyl)-4-piperidin-1-iumyl]methyl-[[3-(3-methoxyphenyl)-1-phenyl-4-pyrazolyl]methyl]ammonium IUPAC Name: [1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl-[[3-(3-methoxyphenyl)-1-phenylpyrazol-4-yl]methyl]azanium Traditional Name: [1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl-[[3-(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]ammonium Formula: C26H36N4O2+2 MolecularWeight: 436.58964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC[NH+]1CCC(CC1)C[NH2+]CC2=CN(N=C2C3=CC(=CC=C3)OC)C4=CC=CC=C4

Isomeric SMILES

COCC[NH+]1CCC(CC1)C[NH2+]CC2=CN(N=C2C3=CC(=CC=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C26H34N4O2/c1-31-16-15-29-13-11-21(12-14-29)18-27-19-23-20-30(24-8-4-3-5-9-24)28-26(23)22-7-6-10-25(17-22)32-2/h3-10,17,20-21,27H,11-16,18-19H2,1-2H3/p+2