ethyl 4-(2-chlorophenyl)-5-oxidanylidene-2-[2-(2,4,5-trimethylimidazol-1-yl)ethoxymethyl]-1,4,6,7-tetrahydropyrrolo[3,4-b]pyridine-3-carboxylate

Systemtic Name: ethyl 4-(2-chlorophenyl)-5-oxidanylidene-2-[2-(2,4,5-trimethylimidazol-1-yl)ethoxymethyl]-1,4,6,7-tetrahydropyrrolo[3,4-b]pyridine-3-carboxylate Openeye Name: ethyl 4-(2-chlorophenyl)-5-oxo-2-[2-(2,4,5-trimethylimidazol-1-yl)ethoxymethyl]-1,4,6,7-tetrahydropyrrolo[3,4-b]pyridine-3-carboxylate CAS Name: 4-(2-chlorophenyl)-5-oxo-2-[2-(2,4,5-trimethyl-1-imidazolyl)ethoxymethyl]-1,4,6,7-tetrahydropyrrolo[3,4-b]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-chlorophenyl)-5-oxo-2-[2-(2,4,5-trimethylimidazol-1-yl)ethoxymethyl]-1,4,6,7-tetrahydropyrrolo[3,4-b]pyridine-3-carboxylate Traditional Name: 4-(2-chlorophenyl)-5-keto-2-[2-(2,4,5-trimethylimidazol-1-yl)ethoxymethyl]-1,4,6,7-tetrahydropyrrolo[3,4-b]pyridine-3-carboxylic acid ethyl ester Formula: C25H29ClN4O4 MolecularWeight: 484.97516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3Cl)C(=O)NC2)COCCN4C(=C(N=C4C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3Cl)C(=O)NC2)COCCN4C(=C(N=C4C)C)C

InChI

InChI=1S/C25H29ClN4O4/c1-5-34-25(32)23-20(13-33-11-10-30-15(3)14(2)28-16(30)4)29-19-12-27-24(31)22(19)21(23)17-8-6-7-9-18(17)26/h6-9,21,29H,5,10-13H2,1-4H3,(H,27,31)