2-azanyl-2-[1-(3-chlorophenyl)-3,5-dimethyl-pyrazol-4-yl]ethanoic acid hydrochloride

Systemtic Name: 2-azanyl-2-[1-(3-chlorophenyl)-3,5-dimethyl-pyrazol-4-yl]ethanoic acid hydrochloride Openeye Name: 2-amino-2-[1-(3-chlorophenyl)-3,5-dimethyl-pyrazol-4-yl]acetic acid hydrochloride CAS Name: 2-amino-2-[1-(3-chlorophenyl)-3,5-dimethyl-4-pyrazolyl]acetic acid hydrochloride IUPAC Name: 2-amino-2-[1-(3-chlorophenyl)-3,5-dimethylpyrazol-4-yl]acetic acid hydrochloride Traditional Name: 2-amino-2-[1-(3-chlorophenyl)-3,5-dimethyl-pyrazol-4-yl]acetic acid hydrochloride Formula: C13H15Cl2N3O2 MolecularWeight: 316.1831

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC(=CC=C2)Cl)C)C(C(=O)O)N.Cl

Isomeric SMILES

CC1=C(C(=NN1C2=CC(=CC=C2)Cl)C)C(C(=O)O)N.Cl

InChI

InChI=1S/C13H14ClN3O2.ClH/c1-7-11(12(15)13(18)19)8(2)17(16-7)10-5-3-4-9(14)6-10;/h3-6,12H,15H2,1-2H3,(H,18,19);1H