2-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoylamino]ethyl-diethyl-azanium Openeye Name: 2-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoylamino]ethyl-diethyl-ammonium CAS Name: 2-[[3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-1-oxopropyl]amino]ethyl-diethylammonium IUPAC Name: 2-[3-(3,5-dimethyl-1-phenylpyrazol-4-yl)propanoylamino]ethyl-diethylazanium Traditional Name: 2-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoylamino]ethyl-diethyl-ammonium Formula: C20H31N4O+ MolecularWeight: 343.48634

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)CCC1=C(N(N=C1C)C2=CC=CC=C2)C

Isomeric SMILES

CC[NH+](CC)CCNC(=O)CCC1=C(N(N=C1C)C2=CC=CC=C2)C

InChI

InChI=1S/C20H30N4O/c1-5-23(6-2)15-14-21-20(25)13-12-19-16(3)22-24(17(19)4)18-10-8-7-9-11-18/h7-11H,5-6,12-15H2,1-4H3,(H,21,25)/p+1