1,3-dimethyl-5-[(1S)-1-phenylethoxy]pyrazole-4-carboxylate

Systemtic Name: 1,3-dimethyl-5-[(1S)-1-phenylethoxy]pyrazole-4-carboxylate Openeye Name: 1,3-dimethyl-5-[(1S)-1-phenylethoxy]pyrazole-4-carboxylate CAS Name: 1,3-dimethyl-5-[(1S)-1-phenylethoxy]-4-pyrazolecarboxylate IUPAC Name: 1,3-dimethyl-5-[(1S)-1-phenylethoxy]pyrazole-4-carboxylate Traditional Name: 1,3-dimethyl-5-[(1S)-1-phenylethoxy]pyrazole-4-carboxylate Formula: C14H15N2O3- MolecularWeight: 259.2805

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)[O-])OC(C)C2=CC=CC=C2)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)[O-])O[C@@H](C)C2=CC=CC=C2)C

InChI

InChI=1S/C14H16N2O3/c1-9-12(14(17)18)13(16(3)15-9)19-10(2)11-7-5-4-6-8-11/h4-8,10H,1-3H3,(H,17,18)/p-1/t10-/m0/s1