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

Systemtic Name: [5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl-(3-morpholin-4-ylpropyl)azanium Openeye Name: 3-morpholinopropyl-[[5-(p-tolyl)-1H-pyrazol-4-yl]methyl]ammonium CAS Name: [5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl-[3-(4-morpholinyl)propyl]ammonium IUPAC Name: [5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl-(3-morpholin-4-ylpropyl)azanium Traditional Name: 3-morpholinopropyl-[[5-(p-tolyl)-1H-pyrazol-4-yl]methyl]ammonium Formula: C18H27N4O+ MolecularWeight: 315.43318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N4O/c1-15-3-5-16(6-4-15)18-17(14-20-21-18)13-19-7-2-8-22-9-11-23-12-10-22/h3-6,14,19H,2,7-13H2,1H3,(H,20,21)/p+1