ethyl 4-methyl-4-oxidanyl-5-oxidanylidene-1-[(E)-pent-3-enyl]pyrrole-2-carboxylate

Systemtic Name: ethyl 4-methyl-4-oxidanyl-5-oxidanylidene-1-[(E)-pent-3-enyl]pyrrole-2-carboxylate Openeye Name: ethyl 4-hydroxy-4-methyl-5-oxo-1-[(E)-pent-3-enyl]pyrrole-2-carboxylate CAS Name: 4-hydroxy-4-methyl-5-oxo-1-[(E)-pent-3-enyl]-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-hydroxy-4-methyl-5-oxo-1-[(E)-pent-3-enyl]pyrrole-2-carboxylate Traditional Name: 4-hydroxy-5-keto-4-methyl-1-[(E)-pent-3-enyl]-2-pyrroline-2-carboxylic acid ethyl ester Formula: C13H19NO4 MolecularWeight: 253.29426

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(C(=O)N1CCC=CC)(C)O

Isomeric SMILES

CCOC(=O)C1=CC(C(=O)N1CC/C=C/C)(C)O

InChI

InChI=1S/C13H19NO4/c1-4-6-7-8-14-10(11(15)18-5-2)9-13(3,17)12(14)16/h4,6,9,17H,5,7-8H2,1-3H3/b6-4+