ethyl 3-phenyl-3-(1H-pyrazol-4-yl)propanoate

Systemtic Name: ethyl 3-phenyl-3-(1H-pyrazol-4-yl)propanoate Openeye Name: ethyl 3-phenyl-3-(1H-pyrazol-4-yl)propanoate CAS Name: 3-phenyl-3-(1H-pyrazol-4-yl)propanoic acid ethyl ester IUPAC Name: ethyl 3-phenyl-3-(1H-pyrazol-4-yl)propanoate Traditional Name: 3-phenyl-3-(1H-pyrazol-4-yl)propionic acid ethyl ester Formula: C14H16N2O2 MolecularWeight: 244.28904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC=CC=C1)C2=CNN=C2

Isomeric SMILES

CCOC(=O)CC(C1=CC=CC=C1)C2=CNN=C2

InChI

InChI=1S/C14H16N2O2/c1-2-18-14(17)8-13(12-9-15-16-10-12)11-6-4-3-5-7-11/h3-7,9-10,13H,2,8H2,1H3,(H,15,16)