1,3-dimethyl-5-(3-pyridin-4-ylpropoxy)pyrazole-4-carboxylate

Systemtic Name: 1,3-dimethyl-5-(3-pyridin-4-ylpropoxy)pyrazole-4-carboxylate Openeye Name: 1,3-dimethyl-5-[3-(4-pyridyl)propoxy]pyrazole-4-carboxylate CAS Name: 1,3-dimethyl-5-(3-pyridin-4-ylpropoxy)-4-pyrazolecarboxylate IUPAC Name: 1,3-dimethyl-5-(3-pyridin-4-ylpropoxy)pyrazole-4-carboxylate Traditional Name: 1,3-dimethyl-5-[3-(4-pyridyl)propoxy]pyrazole-4-carboxylate Formula: C14H16N3O3- MolecularWeight: 274.29514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)[O-])OCCCC2=CC=NC=C2)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)[O-])OCCCC2=CC=NC=C2)C

InChI

InChI=1S/C14H17N3O3/c1-10-12(14(18)19)13(17(2)16-10)20-9-3-4-11-5-7-15-8-6-11/h5-8H,3-4,9H2,1-2H3,(H,18,19)/p-1