ethyl 5-methyl-1-phenyl-2-(2-phenylethynyl)imidazole-4-carboxylate

Systemtic Name: ethyl 5-methyl-1-phenyl-2-(2-phenylethynyl)imidazole-4-carboxylate Openeye Name: ethyl 5-methyl-1-phenyl-2-(2-phenylethynyl)imidazole-4-carboxylate CAS Name: 5-methyl-1-phenyl-2-(2-phenylethynyl)-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-phenyl-2-(2-phenylethynyl)imidazole-4-carboxylate Traditional Name: 5-methyl-1-phenyl-2-(2-phenylethynyl)imidazole-4-carboxylic acid ethyl ester Formula: C21H18N2O2 MolecularWeight: 330.37982

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N2O2/c1-3-25-21(24)20-16(2)23(18-12-8-5-9-13-18)19(22-20)15-14-17-10-6-4-7-11-17/h4-13H,3H2,1-2H3