(2S)-2-(dimethylamino)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanoic acid

Systemtic Name: (2S)-2-(dimethylamino)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanoic acid Openeye Name: (2S)-2-(dimethylamino)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetic acid CAS Name: (2S)-2-(dimethylamino)-2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)acetic acid IUPAC Name: (2S)-2-(dimethylamino)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)acetic acid Traditional Name: (2S)-2-(dimethylamino)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetic acid Formula: C15H19N3O2 MolecularWeight: 273.33026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)[C@@H](C(=O)O)N(C)C

InChI

InChI=1S/C15H19N3O2/c1-10-13(14(15(19)20)17(3)4)11(2)18(16-10)12-8-6-5-7-9-12/h5-9,14H,1-4H3,(H,19,20)/t14-/m0/s1