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

Systemtic Name: 2-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)carbonylamino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[(5-chloro-1,3-dimethyl-pyrazole-4-carbonyl)amino]ethyl-diisopropyl-ammonium CAS Name: 2-[[(5-chloro-1,3-dimethyl-4-pyrazolyl)-oxomethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[(5-chloro-1,3-dimethylpyrazole-4-carbonyl)amino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[(5-chloro-1,3-dimethyl-pyrazole-4-carbonyl)amino]ethyl-diisopropyl-ammonium Formula: C14H26ClN4O+ MolecularWeight: 301.83544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H25ClN4O/c1-9(2)19(10(3)4)8-7-16-14(20)12-11(5)17-18(6)13(12)15/h9-10H,7-8H2,1-6H3,(H,16,20)/p+1