(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl (E)-3-(4-methoxyphenyl)prop-2-enoate

Systemtic Name: (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl (E)-3-(4-methoxyphenyl)prop-2-enoate Openeye Name: (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl (E)-3-(4-methoxyphenyl)prop-2-enoate CAS Name: (E)-3-(4-methoxyphenyl)-2-propenoic acid (4-cyano-5-methyl-2-phenyl-3-pyrazolyl)methyl ester IUPAC Name: (4-cyano-5-methyl-2-phenylpyrazol-3-yl)methyl (E)-3-(4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-methoxyphenyl)acrylic acid (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl ester Formula: C22H19N3O3 MolecularWeight: 373.40456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)COC(=O)C=CC2=CC=C(C=C2)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C#N)COC(=O)/C=C/C2=CC=C(C=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C22H19N3O3/c1-16-20(14-23)21(25(24-16)18-6-4-3-5-7-18)15-28-22(26)13-10-17-8-11-19(27-2)12-9-17/h3-13H,15H2,1-2H3/b13-10+