prop-2-enyl (E)-2-cyano-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoate

Systemtic Name: prop-2-enyl (E)-2-cyano-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoate Openeye Name: allyl (E)-2-cyano-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoate CAS Name: (E)-2-cyano-3-(1,3-diphenyl-4-pyrazolyl)-2-propenoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (E)-2-cyano-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(1,3-diphenylpyrazol-4-yl)acrylic acid allyl ester Formula: C22H17N3O2 MolecularWeight: 355.38928

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C(=CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

C=CCOC(=O)/C(=C/C1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C22H17N3O2/c1-2-13-27-22(26)18(15-23)14-19-16-25(20-11-7-4-8-12-20)24-21(19)17-9-5-3-6-10-17/h2-12,14,16H,1,13H2/b18-14+