2-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[(1-benzyl-3,5-dimethyl-pyrazole-4-carbonyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(1-benzyl-3,5-dimethylpyrazole-4-carbonyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(1-benzyl-3,5-dimethyl-pyrazole-4-carbonyl)amino]ethyl-dimethyl-ammonium Formula: C17H25N4O+ MolecularWeight: 301.4066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)C(=O)NCC[NH+](C)C

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)C(=O)NCC[NH+](C)C

InChI

InChI=1S/C17H24N4O/c1-13-16(17(22)18-10-11-20(3)4)14(2)21(19-13)12-15-8-6-5-7-9-15/h5-9H,10-12H2,1-4H3,(H,18,22)/p+1