dimethyl-[2-[[1-(4-methylphenyl)-5-propan-2-yl-pyrazol-4-yl]carbonylamino]ethyl]azanium

Systemtic Name: dimethyl-[2-[[1-(4-methylphenyl)-5-propan-2-yl-pyrazol-4-yl]carbonylamino]ethyl]azanium Openeye Name: 2-[[5-isopropyl-1-(p-tolyl)pyrazole-4-carbonyl]amino]ethyl-dimethyl-ammonium CAS Name: dimethyl-[2-[[[1-(4-methylphenyl)-5-propan-2-yl-4-pyrazolyl]-oxomethyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[[1-(4-methylphenyl)-5-propan-2-ylpyrazole-4-carbonyl]amino]ethyl]azanium Traditional Name: 2-[[5-isopropyl-1-(p-tolyl)pyrazole-4-carbonyl]amino]ethyl-dimethyl-ammonium Formula: C18H27N4O+ MolecularWeight: 315.43318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCC[NH+](C)C)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCC[NH+](C)C)C(C)C

InChI

InChI=1S/C18H26N4O/c1-13(2)17-16(18(23)19-10-11-21(4)5)12-20-22(17)15-8-6-14(3)7-9-15/h6-9,12-13H,10-11H2,1-5H3,(H,19,23)/p+1