propan-2-yl (E)-2-cyano-3-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoate

Systemtic Name: propan-2-yl (E)-2-cyano-3-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoate Openeye Name: isopropyl (E)-2-cyano-3-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]prop-2-enoate CAS Name: (E)-2-cyano-3-[3-(4-methylphenyl)-1-phenyl-4-pyrazolyl]-2-propenoic acid propan-2-yl ester IUPAC Name: propan-2-yl (E)-2-cyano-3-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]acrylic acid isopropyl ester Formula: C23H21N3O2 MolecularWeight: 371.43174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)OC(C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)OC(C)C)C3=CC=CC=C3

InChI

InChI=1S/C23H21N3O2/c1-16(2)28-23(27)19(14-24)13-20-15-26(21-7-5-4-6-8-21)25-22(20)18-11-9-17(3)10-12-18/h4-13,15-16H,1-3H3/b19-13+