3-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]carbonylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]carbonylamino]propyl-dimethyl-azanium Openeye Name: 3-[[3-(4-methoxyphenyl)-1-phenyl-pyrazole-4-carbonyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[3-(4-methoxyphenyl)-1-phenylpyrazole-4-carbonyl]amino]propyl-dimethylazanium Traditional Name: 3-[[3-(4-methoxyphenyl)-1-phenyl-pyrazole-4-carbonyl]amino]propyl-dimethyl-ammonium Formula: C22H27N4O2+ MolecularWeight: 379.47538

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)C1=CN(N=C1C2=CC=C(C=C2)OC)C3=CC=CC=C3

Isomeric SMILES

C[NH+](C)CCCNC(=O)C1=CN(N=C1C2=CC=C(C=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C22H26N4O2/c1-25(2)15-7-14-23-22(27)20-16-26(18-8-5-4-6-9-18)24-21(20)17-10-12-19(28-3)13-11-17/h4-6,8-13,16H,7,14-15H2,1-3H3,(H,23,27)/p+1