[2-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]phenyl]methylazanium

Systemtic Name: [2-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]phenyl]methylazanium Openeye Name: [2-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]phenyl]methylammonium CAS Name: [2-[[3-(3,5-dimethyl-1-pyrazolyl)-1-oxopropyl]amino]phenyl]methylammonium IUPAC Name: [2-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]phenyl]methylazanium Traditional Name: [2-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]benzyl]ammonium Formula: C15H21N4O+ MolecularWeight: 273.35344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCC(=O)NC2=CC=CC=C2C[NH3+])C

Isomeric SMILES

CC1=CC(=NN1CCC(=O)NC2=CC=CC=C2C[NH3+])C

InChI

InChI=1S/C15H20N4O/c1-11-9-12(2)19(18-11)8-7-15(20)17-14-6-4-3-5-13(14)10-16/h3-6,9H,7-8,10,16H2,1-2H3,(H,17,20)/p+1