ethyl (2S)-3-azanyl-2-(hydroxymethyl)-5-oxidanylidene-1,2-dihydropyrrole-4-carboxylate

Systemtic Name: ethyl (2S)-3-azanyl-2-(hydroxymethyl)-5-oxidanylidene-1,2-dihydropyrrole-4-carboxylate Openeye Name: ethyl (2S)-3-amino-2-(hydroxymethyl)-5-oxo-1,2-dihydropyrrole-4-carboxylate CAS Name: (2S)-3-amino-2-(hydroxymethyl)-5-oxo-1,2-dihydropyrrole-4-carboxylic acid ethyl ester IUPAC Name: ethyl (2S)-3-amino-2-(hydroxymethyl)-5-oxo-1,2-dihydropyrrole-4-carboxylate Traditional Name: (5S)-4-amino-2-keto-5-methylol-3-pyrroline-3-carboxylic acid ethyl ester Formula: C8H12N2O4 MolecularWeight: 200.19188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(NC1=O)CO)N

Isomeric SMILES

CCOC(=O)C1=C([C@H](NC1=O)CO)N

InChI

InChI=1S/C8H12N2O4/c1-2-14-8(13)5-6(9)4(3-11)10-7(5)12/h4,11H,2-3,9H2,1H3,(H,10,12)/t4-/m1/s1