ethyl 2,4-dimethyl-5-(2-morpholin-4-ium-4-ylethanoyl)-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-(2-morpholin-4-ium-4-ylethanoyl)-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-(2-morpholin-4-ium-4-ylacetyl)-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[2-(4-morpholin-4-iumyl)-1-oxoethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-(2-morpholin-4-ium-4-ylacetyl)-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-(2-morpholin-4-ium-4-ylacetyl)-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C15H23N2O4+ MolecularWeight: 295.35412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O4/c1-4-21-15(19)13-10(2)14(16-11(13)3)12(18)9-17-5-7-20-8-6-17/h16H,4-9H2,1-3H3/p+1