(4-pyrazol-1-ylphenyl)methyl (E)-3-quinolin-2-ylprop-2-enoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl (E)-3-quinolin-2-ylprop-2-enoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl (E)-3-(2-quinolyl)prop-2-enoate CAS Name: (E)-3-(2-quinolinyl)-2-propenoic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl (E)-3-quinolin-2-ylprop-2-enoate Traditional Name: (E)-3-(2-quinolyl)acrylic acid (4-pyrazol-1-ylbenzyl) ester Formula: C22H17N3O2 MolecularWeight: 355.38928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C=CC(=O)OCC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)/C=C/C(=O)OCC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C22H17N3O2/c26-22(13-10-19-9-8-18-4-1-2-5-21(18)24-19)27-16-17-6-11-20(12-7-17)25-15-3-14-23-25/h1-15H,16H2/b13-10+