[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl-(3-morpholin-4-ylpropyl)azanium

Systemtic Name: [5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl-(3-morpholin-4-ylpropyl)azanium Openeye Name: [5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl-(3-morpholinopropyl)ammonium CAS Name: [5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl-[3-(4-morpholinyl)propyl]ammonium IUPAC Name: [5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl-(3-morpholin-4-ylpropyl)azanium Traditional Name: [5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl-(3-morpholinopropyl)ammonium Formula: C19H29N4O+ MolecularWeight: 329.45976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(C=NN2)C[NH2+]CCCN3CCOCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(C=NN2)C[NH2+]CCCN3CCOCC3)C

InChI

InChI=1S/C19H28N4O/c1-15-4-5-17(12-16(15)2)19-18(14-21-22-19)13-20-6-3-7-23-8-10-24-11-9-23/h4-5,12,14,20H,3,6-11,13H2,1-2H3,(H,21,22)/p+1