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

Systemtic Name: ethyl 2-methyl-5-oxidanyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-benzyl-5-hydroxy-2-methyl-4-oxo-1H-pyrrole-3-carboxylate CAS Name: 5-hydroxy-2-methyl-4-oxo-5-(phenylmethyl)-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-benzyl-5-hydroxy-2-methyl-4-oxo-1H-pyrrole-3-carboxylate Traditional Name: 5-benzyl-5-hydroxy-4-keto-2-methyl-2-pyrroline-3-carboxylic acid ethyl ester Formula: C15H17NO4 MolecularWeight: 275.29978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(C1=O)(CC2=CC=CC=C2)O)C

Isomeric SMILES

CCOC(=O)C1=C(NC(C1=O)(CC2=CC=CC=C2)O)C

InChI

InChI=1S/C15H17NO4/c1-3-20-14(18)12-10(2)16-15(19,13(12)17)9-11-7-5-4-6-8-11/h4-8,16,19H,3,9H2,1-2H3