methyl 1-butyl-4-[(3-ethoxy-2-oxidanyl-phenyl)methylidene]-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate

Systemtic Name: methyl 1-butyl-4-[(3-ethoxy-2-oxidanyl-phenyl)methylidene]-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl 1-butyl-4-[(3-ethoxy-2-hydroxy-phenyl)methylene]-2-methyl-5-oxo-pyrrole-3-carboxylate CAS Name: 1-butyl-4-[(3-ethoxy-2-hydroxyphenyl)methylidene]-2-methyl-5-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-butyl-4-[(3-ethoxy-2-hydroxyphenyl)methylidene]-2-methyl-5-oxopyrrole-3-carboxylate Traditional Name: 1-butyl-4-(3-ethoxy-2-hydroxy-benzylidene)-5-keto-2-methyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C20H25NO5 MolecularWeight: 359.4162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=CC2=C(C(=CC=C2)OCC)O)C1=O)C(=O)OC)C

Isomeric SMILES

CCCCN1C(=C(C(=CC2=C(C(=CC=C2)OCC)O)C1=O)C(=O)OC)C

InChI

InChI=1S/C20H25NO5/c1-5-7-11-21-13(3)17(20(24)25-4)15(19(21)23)12-14-9-8-10-16(18(14)22)26-6-2/h8-10,12,22H,5-7,11H2,1-4H3