ethyl 3-[[4-(4-chlorophenyl)carbonylphenyl]methyl]-5-(diethoxymethyl)imidazole-4-carboxylate

Systemtic Name: ethyl 3-[[4-(4-chlorophenyl)carbonylphenyl]methyl]-5-(diethoxymethyl)imidazole-4-carboxylate Openeye Name: ethyl 3-[[4-(4-chlorobenzoyl)phenyl]methyl]-5-(diethoxymethyl)imidazole-4-carboxylate CAS Name: 3-[[4-[(4-chlorophenyl)-oxomethyl]phenyl]methyl]-5-(diethoxymethyl)-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[4-(4-chlorobenzoyl)phenyl]methyl]-5-(diethoxymethyl)imidazole-4-carboxylate Traditional Name: 3-[4-(4-chlorobenzoyl)benzyl]-5-(diethoxymethyl)imidazole-4-carboxylic acid ethyl ester Formula: C25H27ClN2O5 MolecularWeight: 470.94528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1=C(N(C=N1)CC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)Cl)C(=O)OCC)OCC

Isomeric SMILES

CCOC(C1=C(N(C=N1)CC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)Cl)C(=O)OCC)OCC

InChI

InChI=1S/C25H27ClN2O5/c1-4-31-24(30)22-21(25(32-5-2)33-6-3)27-16-28(22)15-17-7-9-18(10-8-17)23(29)19-11-13-20(26)14-12-19/h7-14,16,25H,4-6,15H2,1-3H3