[2-oxidanylidene-2-[[2-(phenethylcarbamoyl)phenyl]amino]ethyl] 1H-pyrrole-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[2-(phenethylcarbamoyl)phenyl]amino]ethyl] 1H-pyrrole-2-carboxylate Openeye Name: [2-oxo-2-[2-(phenethylcarbamoyl)anilino]ethyl] 1H-pyrrole-2-carboxylate CAS Name: 1H-pyrrole-2-carboxylic acid [2-oxo-2-[2-[oxo-(phenethylamino)methyl]anilino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(phenethylcarbamoyl)anilino]ethyl] 1H-pyrrole-2-carboxylate Traditional Name: 1H-pyrrole-2-carboxylic acid [2-keto-2-[2-(phenethylcarbamoyl)anilino]ethyl] ester Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=CC=CN3

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=CC=CN3

InChI

InChI=1S/C22H21N3O4/c26-20(15-29-22(28)19-11-6-13-23-19)25-18-10-5-4-9-17(18)21(27)24-14-12-16-7-2-1-3-8-16/h1-11,13,23H,12,14-15H2,(H,24,27)(H,25,26)