[5-methoxy-2-[3-phenyl-2-[(E)-3-phenylprop-2-enoyl]-3,4-dihydropyrazol-5-yl]phenyl] (E)-3-phenylprop-2-enoate

Systemtic Name: [5-methoxy-2-[3-phenyl-2-[(E)-3-phenylprop-2-enoyl]-3,4-dihydropyrazol-5-yl]phenyl] (E)-3-phenylprop-2-enoate Openeye Name: [5-methoxy-2-[3-phenyl-2-[(E)-3-phenylprop-2-enoyl]-3,4-dihydropyrazol-5-yl]phenyl] (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid [5-methoxy-2-[2-[(E)-1-oxo-3-phenylprop-2-enyl]-3-phenyl-3,4-dihydropyrazol-5-yl]phenyl] ester IUPAC Name: [5-methoxy-2-[3-phenyl-2-[(E)-3-phenylprop-2-enoyl]-3,4-dihydropyrazol-5-yl]phenyl] (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid [5-methoxy-2-[5-phenyl-1-[(E)-3-phenylacryloyl]-2-pyrazolin-3-yl]phenyl] ester Formula: C34H28N2O4 MolecularWeight: 528.59712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=NN(C(C2)C3=CC=CC=C3)C(=O)C=CC4=CC=CC=C4)OC(=O)C=CC5=CC=CC=C5

Isomeric SMILES

COC1=CC(=C(C=C1)C2=NN(C(C2)C3=CC=CC=C3)C(=O)/C=C/C4=CC=CC=C4)OC(=O)/C=C/C5=CC=CC=C5

InChI

InChI=1S/C34H28N2O4/c1-39-28-19-20-29(32(23-28)40-34(38)22-18-26-13-7-3-8-14-26)30-24-31(27-15-9-4-10-16-27)36(35-30)33(37)21-17-25-11-5-2-6-12-25/h2-23,31H,24H2,1H3/b21-17+,22-18+