4-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]morpholin-4-ium

Systemtic Name: 4-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]morpholin-4-ium Openeye Name: 4-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]morpholin-4-ium CAS Name: 4-[[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methyl]morpholin-4-ium IUPAC Name: 4-[[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methyl]morpholin-4-ium Traditional Name: 4-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]morpholin-4-ium Formula: C21H24N3O2+ MolecularWeight: 350.43416

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2C[NH+]3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2C[NH+]3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O2/c1-25-20-9-7-17(8-10-20)21-18(15-23-11-13-26-14-12-23)16-24(22-21)19-5-3-2-4-6-19/h2-10,16H,11-15H2,1H3/p+1