(4-cyanophenyl)methyl 3-[1-phenyl-3-(4-phenylphenyl)pyrazol-4-yl]prop-2-enoate

Systemtic Name: (4-cyanophenyl)methyl 3-[1-phenyl-3-(4-phenylphenyl)pyrazol-4-yl]prop-2-enoate Openeye Name: (4-cyanophenyl)methyl 3-[1-phenyl-3-(4-phenylphenyl)pyrazol-4-yl]prop-2-enoate CAS Name: 3-[1-phenyl-3-(4-phenylphenyl)-4-pyrazolyl]-2-propenoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 3-[1-phenyl-3-(4-phenylphenyl)pyrazol-4-yl]prop-2-enoate Traditional Name: 3-[1-phenyl-3-(4-phenylphenyl)pyrazol-4-yl]acrylic acid (4-cyanobenzyl) ester Formula: C32H23N3O2 MolecularWeight: 481.54392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NN(C=C3C=CC(=O)OCC4=CC=C(C=C4)C#N)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NN(C=C3C=CC(=O)OCC4=CC=C(C=C4)C#N)C5=CC=CC=C5

InChI

InChI=1S/C32H23N3O2/c33-21-24-11-13-25(14-12-24)23-37-31(36)20-19-29-22-35(30-9-5-2-6-10-30)34-32(29)28-17-15-27(16-18-28)26-7-3-1-4-8-26/h1-20,22H,23H2