diethyl 2-(1-methylpyrrol-2-yl)-2-oxidanyl-propanedioate

Systemtic Name: diethyl 2-(1-methylpyrrol-2-yl)-2-oxidanyl-propanedioate Openeye Name: diethyl 2-hydroxy-2-(1-methylpyrrol-2-yl)propanedioate CAS Name: 2-hydroxy-2-(1-methyl-2-pyrrolyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-hydroxy-2-(1-methylpyrrol-2-yl)propanedioate Traditional Name: 2-hydroxy-2-(1-methylpyrrol-2-yl)malonic acid diethyl ester Formula: C12H17NO5 MolecularWeight: 255.26708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CN1C)(C(=O)OCC)O

Isomeric SMILES

CCOC(=O)C(C1=CC=CN1C)(C(=O)OCC)O

InChI

InChI=1S/C12H17NO5/c1-4-17-10(14)12(16,11(15)18-5-2)9-7-6-8-13(9)3/h6-8,16H,4-5H2,1-3H3