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

Systemtic Name: 2-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[(5-chloro-3-methyl-1-phenyl-pyrazole-4-carbonyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(5-chloro-3-methyl-1-phenylpyrazole-4-carbonyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(5-chloro-3-methyl-1-phenyl-pyrazole-4-carbonyl)amino]ethyl-dimethyl-ammonium Formula: C15H20ClN4O+ MolecularWeight: 307.7985

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCC[NH+](C)C)Cl)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCC[NH+](C)C)Cl)C2=CC=CC=C2

InChI

InChI=1S/C15H19ClN4O/c1-11-13(15(21)17-9-10-19(2)3)14(16)20(18-11)12-7-5-4-6-8-12/h4-8H,9-10H2,1-3H3,(H,17,21)/p+1