(phenylmethyl) (2Z)-3-oxidanylidene-2-[(2-phenyl-1H-imidazol-5-yl)methylidene]butanoate

Systemtic Name: (phenylmethyl) (2Z)-3-oxidanylidene-2-[(2-phenyl-1H-imidazol-5-yl)methylidene]butanoate Openeye Name: benzyl (2Z)-3-oxo-2-[(2-phenyl-1H-imidazol-5-yl)methylene]butanoate CAS Name: (2Z)-3-oxo-2-[(2-phenyl-1H-imidazol-5-yl)methylidene]butanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2Z)-3-oxo-2-[(2-phenyl-1H-imidazol-5-yl)methylidene]butanoate Traditional Name: (Z)-2-acetyl-3-(2-phenyl-1H-imidazol-5-yl)acrylic acid benzyl ester Formula: C21H18N2O3 MolecularWeight: 346.37922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CN=C(N1)C2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(=O)/C(=C/C1=CN=C(N1)C2=CC=CC=C2)/C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H18N2O3/c1-15(24)19(21(25)26-14-16-8-4-2-5-9-16)12-18-13-22-20(23-18)17-10-6-3-7-11-17/h2-13H,14H2,1H3,(H,22,23)/b19-12-