(Z)-2-cyano-3-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]prop-2-enoic acid

Systemtic Name: (Z)-2-cyano-3-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]prop-2-enoic acid Openeye Name: (Z)-3-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]-2-cyano-prop-2-enoic acid CAS Name: (Z)-2-cyano-3-[1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolyl]-2-propenoic acid IUPAC Name: (Z)-3-(1-benzyl-3-pyridin-3-ylpyrazol-4-yl)-2-cyanoprop-2-enoic acid Traditional Name: (Z)-3-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]-2-cyano-acrylic acid Formula: C19H14N4O2 MolecularWeight: 330.34006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CN=CC=C3)C=C(C#N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CN=CC=C3)/C=C(/C#N)\C(=O)O

InChI

InChI=1S/C19H14N4O2/c20-10-16(19(24)25)9-17-13-23(12-14-5-2-1-3-6-14)22-18(17)15-7-4-8-21-11-15/h1-9,11,13H,12H2,(H,24,25)/b16-9-