[4-[[(2R)-2-(3,5-dimethylpyrazol-1-yl)propanoyl]amino]phenyl]methylazanium

Systemtic Name: [4-[[(2R)-2-(3,5-dimethylpyrazol-1-yl)propanoyl]amino]phenyl]methylazanium Openeye Name: [4-[[(2R)-2-(3,5-dimethylpyrazol-1-yl)propanoyl]amino]phenyl]methylammonium CAS Name: [4-[[(2R)-2-(3,5-dimethyl-1-pyrazolyl)-1-oxopropyl]amino]phenyl]methylammonium IUPAC Name: [4-[[(2R)-2-(3,5-dimethylpyrazol-1-yl)propanoyl]amino]phenyl]methylazanium Traditional Name: [4-[[(2R)-2-(3,5-dimethylpyrazol-1-yl)propanoyl]amino]benzyl]ammonium Formula: C15H21N4O+ MolecularWeight: 273.35344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(C)C(=O)NC2=CC=C(C=C2)C[NH3+])C

Isomeric SMILES

CC1=CC(=NN1[C@H](C)C(=O)NC2=CC=C(C=C2)C[NH3+])C

InChI

InChI=1S/C15H20N4O/c1-10-8-11(2)19(18-10)12(3)15(20)17-14-6-4-13(9-16)5-7-14/h4-8,12H,9,16H2,1-3H3,(H,17,20)/p+1/t12-/m1/s1