ethyl 1-methyl-4-[2-oxidanylidene-2-[(4-phenylmethoxyphenyl)amino]ethyl]pyrrolo[3,2-b]pyrrole-5-carboxylate

Systemtic Name: ethyl 1-methyl-4-[2-oxidanylidene-2-[(4-phenylmethoxyphenyl)amino]ethyl]pyrrolo[3,2-b]pyrrole-5-carboxylate Openeye Name: ethyl 4-[2-(4-benzyloxyanilino)-2-oxo-ethyl]-1-methyl-pyrrolo[3,2-b]pyrrole-5-carboxylate CAS Name: 1-methyl-4-[2-oxo-2-(4-phenylmethoxyanilino)ethyl]-5-pyrrolo[3,2-b]pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-methyl-4-[2-oxo-2-(4-phenylmethoxyanilino)ethyl]pyrrolo[3,2-b]pyrrole-5-carboxylate Traditional Name: 4-[2-(4-benzoxyanilino)-2-keto-ethyl]-1-methyl-pyrrolo[3,2-b]pyrrole-5-carboxylic acid ethyl ester Formula: C25H25N3O4 MolecularWeight: 431.4837

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N1CC(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4)C=CN2C

Isomeric SMILES

CCOC(=O)C1=CC2=C(N1CC(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4)C=CN2C

InChI

InChI=1S/C25H25N3O4/c1-3-31-25(30)23-15-22-21(13-14-27(22)2)28(23)16-24(29)26-19-9-11-20(12-10-19)32-17-18-7-5-4-6-8-18/h4-15H,3,16-17H2,1-2H3,(H,26,29)