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

Systemtic Name: O2-[2-[1-(2,5-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl] O4-methyl 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[2-[1-(2,5-dimethoxyphenyl)ethylamino]-2-oxo-ethyl] O4-methyl 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-[1-(2,5-dimethoxyphenyl)ethylamino]-2-oxoethyl] ester O4-methyl ester IUPAC Name: 2-O-[2-[1-(2,5-dimethoxyphenyl)ethylamino]-2-oxoethyl] 4-O-methyl 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-[1-(2,5-dimethoxyphenyl)ethylamino]-2-keto-ethyl] ester O4-methyl ester Formula: C22H28N2O7 MolecularWeight: 432.46692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O7/c1-7-16-19(21(26)30-6)12(2)20(24-16)22(27)31-11-18(25)23-13(3)15-10-14(28-4)8-9-17(15)29-5/h8-10,13,24H,7,11H2,1-6H3,(H,23,25)