tert-butyl (E)-3-[3-[(E)-2-(4-methylphenyl)ethenyl]-2-pyrazol-1-yl-phenyl]prop-2-enoate

Systemtic Name: tert-butyl (E)-3-[3-[(E)-2-(4-methylphenyl)ethenyl]-2-pyrazol-1-yl-phenyl]prop-2-enoate Openeye Name: tert-butyl (E)-3-[3-[(E)-2-(p-tolyl)vinyl]-2-pyrazol-1-yl-phenyl]prop-2-enoate CAS Name: (E)-3-[3-[(E)-2-(4-methylphenyl)ethenyl]-2-(1-pyrazolyl)phenyl]-2-propenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-3-[3-[(E)-2-(4-methylphenyl)ethenyl]-2-pyrazol-1-ylphenyl]prop-2-enoate Traditional Name: (E)-3-[3-[(E)-2-(p-tolyl)vinyl]-2-pyrazol-1-yl-phenyl]acrylic acid tert-butyl ester Formula: C25H26N2O2 MolecularWeight: 386.48614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC2=C(C(=CC=C2)C=CC(=O)OC(C)(C)C)N3C=CC=N3

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C2=C(C(=CC=C2)/C=C/C(=O)OC(C)(C)C)N3C=CC=N3

InChI

InChI=1S/C25H26N2O2/c1-19-9-11-20(12-10-19)13-14-21-7-5-8-22(24(21)27-18-6-17-26-27)15-16-23(28)29-25(2,3)4/h5-18H,1-4H3/b14-13+,16-15+