ethyl 3-[3-[2-(5-ethyl-3,4-diphenyl-pyrazol-1-yl)phenyl]phenyl]propanoate

Systemtic Name: ethyl 3-[3-[2-(5-ethyl-3,4-diphenyl-pyrazol-1-yl)phenyl]phenyl]propanoate Openeye Name: ethyl 3-[3-[2-(5-ethyl-3,4-diphenyl-pyrazol-1-yl)phenyl]phenyl]propanoate CAS Name: 3-[3-[2-(5-ethyl-3,4-diphenyl-1-pyrazolyl)phenyl]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3-[2-(5-ethyl-3,4-diphenylpyrazol-1-yl)phenyl]phenyl]propanoate Traditional Name: 3-[3-[2-(5-ethyl-3,4-diphenyl-pyrazol-1-yl)phenyl]phenyl]propionic acid ethyl ester Formula: C34H32N2O2 MolecularWeight: 500.63008

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1C2=CC=CC=C2C3=CC(=CC=C3)CCC(=O)OCC)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCC1=C(C(=NN1C2=CC=CC=C2C3=CC(=CC=C3)CCC(=O)OCC)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C34H32N2O2/c1-3-30-33(26-15-7-5-8-16-26)34(27-17-9-6-10-18-27)35-36(30)31-21-12-11-20-29(31)28-19-13-14-25(24-28)22-23-32(37)38-4-2/h5-21,24H,3-4,22-23H2,1-2H3