[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 4-ethanoyl-1H-pyrrole-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 4-ethanoyl-1H-pyrrole-2-carboxylate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 4-acetyl-1H-pyrrole-2-carboxylate CAS Name: 4-acetyl-1H-pyrrole-2-carboxylic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 4-acetyl-1H-pyrrole-2-carboxylate Traditional Name: 4-acetyl-1H-pyrrole-2-carboxylic acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C13H17N3O5 MolecularWeight: 295.29118

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)COC(=O)C1=CC(=CN1)C(=O)C

Isomeric SMILES

CCCNC(=O)NC(=O)COC(=O)C1=CC(=CN1)C(=O)C

InChI

InChI=1S/C13H17N3O5/c1-3-4-14-13(20)16-11(18)7-21-12(19)10-5-9(6-15-10)8(2)17/h5-6,15H,3-4,7H2,1-2H3,(H2,14,16,18,20)