3-[ethyl(phenyl)amino]propyl-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]azanium

Systemtic Name: 3-[ethyl(phenyl)amino]propyl-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]azanium Openeye Name: 3-(N-ethylanilino)propyl-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]ammonium CAS Name: 3-(N-ethylanilino)propyl-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]ammonium IUPAC Name: 3-(N-ethylanilino)propyl-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]azanium Traditional Name: 3-(N-ethylanilino)propyl-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]ammonium Formula: C22H29N4O+ MolecularWeight: 365.49186

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC[NH2+]CC1=C(NN=C1)C2=CC=C(C=C2)OC)C3=CC=CC=C3

Isomeric SMILES

CCN(CCC[NH2+]CC1=C(NN=C1)C2=CC=C(C=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C22H28N4O/c1-3-26(20-8-5-4-6-9-20)15-7-14-23-16-19-17-24-25-22(19)18-10-12-21(27-2)13-11-18/h4-6,8-13,17,23H,3,7,14-16H2,1-2H3,(H,24,25)/p+1