O4-methyl O2-[2-[2-(3-methylphenoxy)ethylamino]-2-oxidanylidene-ethyl] 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O4-methyl O2-[2-[2-(3-methylphenoxy)ethylamino]-2-oxidanylidene-ethyl] 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-methyl O2-[2-[2-(3-methylphenoxy)ethylamino]-2-oxo-ethyl] 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylic acid O4-methyl ester O2-[2-[2-(3-methylphenoxy)ethylamino]-2-oxoethyl] ester IUPAC Name: 4-O-methyl 2-O-[2-[2-(3-methylphenoxy)ethylamino]-2-oxoethyl] 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-keto-2-[2-(3-methylphenoxy)ethylamino]ethyl] ester O4-methyl ester Formula: C21H26N2O6 MolecularWeight: 402.44094

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)OCC(=O)NCCOC2=CC=CC(=C2)C)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)OCC(=O)NCCOC2=CC=CC(=C2)C)C)C(=O)OC

InChI

InChI=1S/C21H26N2O6/c1-5-16-18(20(25)27-4)14(3)19(23-16)21(26)29-12-17(24)22-9-10-28-15-8-6-7-13(2)11-15/h6-8,11,23H,5,9-10,12H2,1-4H3,(H,22,24)