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

Systemtic Name: O4-ethyl O2-[1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[2-(benzylamino)-1-methyl-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-[1-oxo-1-[(phenylmethyl)amino]propan-2-yl] ester IUPAC Name: 2-O-[1-(benzylamino)-1-oxopropan-2-yl] 4-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(benzylamino)-2-keto-1-methyl-ethyl] ester O4-ethyl ester Formula: C20H24N2O5 MolecularWeight: 372.41496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O5/c1-5-26-19(24)16-12(2)17(22-13(16)3)20(25)27-14(4)18(23)21-11-15-9-7-6-8-10-15/h6-10,14,22H,5,11H2,1-4H3,(H,21,23)