ethyl 4-[(3-hydroxyphenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxidanylidene-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[(3-hydroxyphenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: ethyl 4-[(3-hydroxyphenyl)methylene]-1-isobutyl-2-methyl-5-oxo-pyrrole-3-carboxylate CAS Name: 4-[(3-hydroxyphenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxo-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3-hydroxyphenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxopyrrole-3-carboxylate Traditional Name: 4-(3-hydroxybenzylidene)-1-isobutyl-5-keto-2-methyl-2-pyrroline-3-carboxylic acid ethyl ester Formula: C19H23NO4 MolecularWeight: 329.39022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23NO4/c1-5-24-19(23)17-13(4)20(11-12(2)3)18(22)16(17)10-14-7-6-8-15(21)9-14/h6-10,12,21H,5,11H2,1-4H3