O4-ethyl O2-[2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-[2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[2-(benzylcarbamoylamino)-2-oxo-ethyl] O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-ethyl ester O2-[2-oxo-2-[[oxo-[(phenylmethyl)amino]methyl]amino]ethyl] ester IUPAC Name: 2-O-[2-(benzylcarbamoylamino)-2-oxoethyl] 4-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(benzylcarbamoylamino)-2-keto-ethyl] ester O4-ethyl ester Formula: C20H23N3O6 MolecularWeight: 401.41312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC(=O)NC(=O)NCC2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC(=O)NC(=O)NCC2=CC=CC=C2)C

InChI

InChI=1S/C20H23N3O6/c1-4-28-18(25)16-12(2)17(22-13(16)3)19(26)29-11-15(24)23-20(27)21-10-14-8-6-5-7-9-14/h5-9,22H,4,10-11H2,1-3H3,(H2,21,23,24,27)