dimethyl 1-(2-oxidanylidene-4-phenyl-butyl)imidazole-4,5-dicarboxylate

Systemtic Name: dimethyl 1-(2-oxidanylidene-4-phenyl-butyl)imidazole-4,5-dicarboxylate Openeye Name: dimethyl 1-(2-oxo-4-phenyl-butyl)imidazole-4,5-dicarboxylate CAS Name: 1-(2-oxo-4-phenylbutyl)imidazole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-(2-oxo-4-phenylbutyl)imidazole-4,5-dicarboxylate Traditional Name: 1-(2-keto-4-phenyl-butyl)imidazole-4,5-dicarboxylic acid dimethyl ester Formula: C17H18N2O5 MolecularWeight: 330.33522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(C=N1)CC(=O)CCC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(N(C=N1)CC(=O)CCC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C17H18N2O5/c1-23-16(21)14-15(17(22)24-2)19(11-18-14)10-13(20)9-8-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3