diethyl 3-methyl-5-(morpholin-4-ium-4-ylmethyl)-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-(morpholin-4-ium-4-ylmethyl)-1H-pyrrole-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-(morpholin-4-ium-4-ylmethyl)-1H-pyrrole-2,4-dicarboxylate CAS Name: 3-methyl-5-(4-morpholin-4-iumylmethyl)-1H-pyrrole-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-(morpholin-4-ium-4-ylmethyl)-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3-methyl-5-(morpholin-4-ium-4-ylmethyl)-1H-pyrrole-2,4-dicarboxylic acid diethyl ester Formula: C16H25N2O5+ MolecularWeight: 325.3801

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)C[NH+]2CCOCC2

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)C[NH+]2CCOCC2

InChI

InChI=1S/C16H24N2O5/c1-4-22-15(19)13-11(3)14(16(20)23-5-2)17-12(13)10-18-6-8-21-9-7-18/h17H,4-10H2,1-3H3/p+1