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

Systemtic Name: 2-[(5-ethyl-1-phenyl-3-propyl-pyrazol-4-yl)carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[(5-ethyl-1-phenyl-3-propyl-pyrazole-4-carbonyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(5-ethyl-1-phenyl-3-propyl-4-pyrazolyl)-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(5-ethyl-1-phenyl-3-propylpyrazole-4-carbonyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(5-ethyl-1-phenyl-3-propyl-pyrazole-4-carbonyl)amino]ethyl-dimethyl-ammonium Formula: C19H29N4O+ MolecularWeight: 329.45976

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1C(=O)NCC[NH+](C)C)CC)C2=CC=CC=C2

Isomeric SMILES

CCCC1=NN(C(=C1C(=O)NCC[NH+](C)C)CC)C2=CC=CC=C2

InChI

InChI=1S/C19H28N4O/c1-5-10-16-18(19(24)20-13-14-22(3)4)17(6-2)23(21-16)15-11-8-7-9-12-15/h7-9,11-12H,5-6,10,13-14H2,1-4H3,(H,20,24)/p+1