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

Systemtic Name: O2-[2-[(2,4-dimethylphenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl] O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[2-[(2,4-dimethylphenyl)methyl-methyl-amino]-2-oxo-ethyl] O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-[(2,4-dimethylphenyl)methyl-methylamino]-2-oxoethyl] ester O4-ethyl ester IUPAC Name: 2-O-[2-[(2,4-dimethylphenyl)methyl-methylamino]-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-[(2,4-dimethylbenzyl)-methyl-amino]-2-keto-ethyl] ester O4-ethyl ester Formula: C22H28N2O5 MolecularWeight: 400.46812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC(=O)N(C)CC2=C(C=C(C=C2)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC(=O)N(C)CC2=C(C=C(C=C2)C)C)C

InChI

InChI=1S/C22H28N2O5/c1-7-28-21(26)19-15(4)20(23-16(19)5)22(27)29-12-18(25)24(6)11-17-9-8-13(2)10-14(17)3/h8-10,23H,7,11-12H2,1-6H3