methyl (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]but-2-enoate

Systemtic Name: methyl (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]but-2-enoate Openeye Name: methyl (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]but-2-enoate CAS Name: (Z)-3-[4-(1-imidazolylmethyl)phenyl]-2-butenoic acid methyl ester IUPAC Name: methyl (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]but-2-enoate Traditional Name: (Z)-3-[4-(imidazol-1-ylmethyl)phenyl]but-2-enoic acid methyl ester Formula: C15H16N2O2 MolecularWeight: 256.29974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)OC)C1=CC=C(C=C1)CN2C=CN=C2

Isomeric SMILES

C/C(=C/C(=O)OC)/C1=CC=C(C=C1)CN2C=CN=C2

InChI

InChI=1S/C15H16N2O2/c1-12(9-15(18)19-2)14-5-3-13(4-6-14)10-17-8-7-16-11-17/h3-9,11H,10H2,1-2H3/b12-9-