1,3-dimethyl-5-[(2S)-octan-2-yl]oxy-pyrazole-4-carboxylate

Systemtic Name: 1,3-dimethyl-5-[(2S)-octan-2-yl]oxy-pyrazole-4-carboxylate Openeye Name: 1,3-dimethyl-5-[(1S)-1-methylheptoxy]pyrazole-4-carboxylate CAS Name: 1,3-dimethyl-5-[(2S)-octan-2-yl]oxy-4-pyrazolecarboxylate IUPAC Name: 1,3-dimethyl-5-[(2S)-octan-2-yl]oxypyrazole-4-carboxylate Traditional Name: 1,3-dimethyl-5-[(1S)-1-methylheptoxy]pyrazole-4-carboxylate Formula: C14H23N2O3- MolecularWeight: 267.34402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC1=C(C(=NN1C)C)C(=O)[O-]

Isomeric SMILES

CCCCCC[C@H](C)OC1=C(C(=NN1C)C)C(=O)[O-]

InChI

InChI=1S/C14H24N2O3/c1-5-6-7-8-9-10(2)19-13-12(14(17)18)11(3)15-16(13)4/h10H,5-9H2,1-4H3,(H,17,18)/p-1/t10-/m0/s1