O1-butyl O2-ethyl 4-(4-methylphenyl)-3-morpholin-4-yl-pyrrole-1,2-dicarboxylate

Systemtic Name: O1-butyl O2-ethyl 4-(4-methylphenyl)-3-morpholin-4-yl-pyrrole-1,2-dicarboxylate Openeye Name: O1-butyl O2-ethyl 3-morpholino-4-(p-tolyl)pyrrole-1,2-dicarboxylate CAS Name: 4-(4-methylphenyl)-3-(4-morpholinyl)pyrrole-1,2-dicarboxylic acid O1-butyl ester O2-ethyl ester IUPAC Name: 1-O-butyl 2-O-ethyl 4-(4-methylphenyl)-3-morpholin-4-ylpyrrole-1,2-dicarboxylate Traditional Name: 3-morpholino-4-(p-tolyl)pyrrole-1,2-dicarboxylic acid O1-butyl ester O2-ethyl ester Formula: C23H30N2O5 MolecularWeight: 414.4947

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)N1C=C(C(=C1C(=O)OCC)N2CCOCC2)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCOC(=O)N1C=C(C(=C1C(=O)OCC)N2CCOCC2)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H30N2O5/c1-4-6-13-30-23(27)25-16-19(18-9-7-17(3)8-10-18)20(21(25)22(26)29-5-2)24-11-14-28-15-12-24/h7-10,16H,4-6,11-15H2,1-3H3