2-[1-tert-butyl-3-(3-methoxyphenyl)pyrazol-4-yl]ethanoate

Systemtic Name: 2-[1-tert-butyl-3-(3-methoxyphenyl)pyrazol-4-yl]ethanoate Openeye Name: 2-[1-tert-butyl-3-(3-methoxyphenyl)pyrazol-4-yl]acetate CAS Name: 2-[1-tert-butyl-3-(3-methoxyphenyl)-4-pyrazolyl]acetate IUPAC Name: 2-[1-tert-butyl-3-(3-methoxyphenyl)pyrazol-4-yl]acetate Traditional Name: 2-[1-tert-butyl-3-(3-methoxyphenyl)pyrazol-4-yl]acetate Formula: C16H19N2O3- MolecularWeight: 287.33366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C(=N1)C2=CC(=CC=C2)OC)CC(=O)[O-]

Isomeric SMILES

CC(C)(C)N1C=C(C(=N1)C2=CC(=CC=C2)OC)CC(=O)[O-]

InChI

InChI=1S/C16H20N2O3/c1-16(2,3)18-10-12(9-14(19)20)15(17-18)11-6-5-7-13(8-11)21-4/h5-8,10H,9H2,1-4H3,(H,19,20)/p-1