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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC(=O)NC(=O)NCC2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC(=O)NC(=O)NCC2=CC=CC=C2)C

InChI

InChI=1S/C20H23N3O6/c1-4-28-19(26)17-12(2)16(13(3)22-17)18(25)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)