2-methoxyethyl-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]-[(5-phenyl-1H-pyrazol-4-yl)methyl]azanium

Systemtic Name: 2-methoxyethyl-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]-[(5-phenyl-1H-pyrazol-4-yl)methyl]azanium Openeye Name: 2-methoxyethyl-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]-[(5-phenyl-1H-pyrazol-4-yl)methyl]ammonium CAS Name: 2-methoxyethyl-[[1-[(2-methoxyphenyl)methyl]-4-piperidin-1-iumyl]methyl]-[(5-phenyl-1H-pyrazol-4-yl)methyl]ammonium IUPAC Name: 2-methoxyethyl-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]-[(5-phenyl-1H-pyrazol-4-yl)methyl]azanium Traditional Name: 2-methoxyethyl-[(1-o-anisylpiperidin-1-ium-4-yl)methyl]-[(5-phenyl-1H-pyrazol-4-yl)methyl]ammonium Formula: C27H38N4O2+2 MolecularWeight: 450.61622

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH+](CC1CC[NH+](CC1)CC2=CC=CC=C2OC)CC3=C(NN=C3)C4=CC=CC=C4

Isomeric SMILES

COCC[NH+](CC1CC[NH+](CC1)CC2=CC=CC=C2OC)CC3=C(NN=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H36N4O2/c1-32-17-16-31(21-25-18-28-29-27(25)23-8-4-3-5-9-23)19-22-12-14-30(15-13-22)20-24-10-6-7-11-26(24)33-2/h3-11,18,22H,12-17,19-21H2,1-2H3,(H,28,29)/p+2