cyanomethyl 3-(1-phenylpyrazol-4-yl)propanoate

Systemtic Name: cyanomethyl 3-(1-phenylpyrazol-4-yl)propanoate Openeye Name: cyanomethyl 3-(1-phenylpyrazol-4-yl)propanoate CAS Name: 3-(1-phenyl-4-pyrazolyl)propanoic acid cyanomethyl ester IUPAC Name: cyanomethyl 3-(1-phenylpyrazol-4-yl)propanoate Traditional Name: 3-(1-phenylpyrazol-4-yl)propionic acid cyanomethyl ester Formula: C14H13N3O2 MolecularWeight: 255.27192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CCC(=O)OCC#N

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CCC(=O)OCC#N

InChI

InChI=1S/C14H13N3O2/c15-8-9-19-14(18)7-6-12-10-16-17(11-12)13-4-2-1-3-5-13/h1-5,10-11H,6-7,9H2