O5-ethyl O1-(phenylmethyl) 2-[(4-methylphenyl)amino]imidazole-1,5-dicarboxylate

Systemtic Name: O5-ethyl O1-(phenylmethyl) 2-[(4-methylphenyl)amino]imidazole-1,5-dicarboxylate Openeye Name: O1-benzyl O5-ethyl 2-(4-methylanilino)imidazole-1,5-dicarboxylate CAS Name: 2-(4-methylanilino)imidazole-1,5-dicarboxylic acid O5-ethyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 5-O-ethyl 2-(4-methylanilino)imidazole-1,5-dicarboxylate Traditional Name: 2-(p-toluidino)imidazole-1,5-dicarboxylic acid O1-benzyl ester O5-ethyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N1C(=O)OCC2=CC=CC=C2)NC3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N1C(=O)OCC2=CC=CC=C2)NC3=CC=C(C=C3)C

InChI

InChI=1S/C21H21N3O4/c1-3-27-19(25)18-13-22-20(23-17-11-9-15(2)10-12-17)24(18)21(26)28-14-16-7-5-4-6-8-16/h4-13H,3,14H2,1-2H3,(H,22,23)