methyl 2-(hydroxymethyl)-4-methyl-5-oxidanyl-3-oxidanylidene-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 2-(hydroxymethyl)-4-methyl-5-oxidanyl-3-oxidanylidene-1H-pyrrole-2-carboxylate Openeye Name: methyl 5-hydroxy-2-(hydroxymethyl)-4-methyl-3-oxo-1H-pyrrole-2-carboxylate CAS Name: 5-hydroxy-2-(hydroxymethyl)-4-methyl-3-oxo-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-hydroxy-2-(hydroxymethyl)-4-methyl-3-oxo-1H-pyrrole-2-carboxylate Traditional Name: 5-hydroxy-3-keto-4-methyl-2-methylol-2-pyrroline-2-carboxylic acid methyl ester Formula: C8H11NO5 MolecularWeight: 201.17664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(C1=O)(CO)C(=O)OC)O

Isomeric SMILES

CC1=C(NC(C1=O)(CO)C(=O)OC)O

InChI

InChI=1S/C8H11NO5/c1-4-5(11)8(3-10,7(13)14-2)9-6(4)12/h9-10,12H,3H2,1-2H3