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

Systemtic Name: propan-2-yl 1-methyl-4-[2-oxidanylidene-2-[(4-phenylmethoxyphenyl)amino]ethyl]pyrrolo[3,2-b]pyrrole-5-carboxylate Openeye Name: isopropyl 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 propan-2-yl ester IUPAC Name: propan-2-yl 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 isopropyl ester Formula: C26H27N3O4 MolecularWeight: 445.51028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H27N3O4/c1-18(2)33-26(31)24-15-23-22(13-14-28(23)3)29(24)16-25(30)27-20-9-11-21(12-10-20)32-17-19-7-5-4-6-8-19/h4-15,18H,16-17H2,1-3H3,(H,27,30)