ethyl (5E)-5-[(2,6-dimethoxyphenyl)methylidene]-2-methyl-4-oxidanylidene-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl (5E)-5-[(2,6-dimethoxyphenyl)methylidene]-2-methyl-4-oxidanylidene-1H-pyrrole-3-carboxylate Openeye Name: ethyl (5E)-5-[(2,6-dimethoxyphenyl)methylene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylate CAS Name: (5E)-5-[(2,6-dimethoxyphenyl)methylidene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (5E)-5-[(2,6-dimethoxyphenyl)methylidene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylate Traditional Name: (5E)-5-(2,6-dimethoxybenzylidene)-4-keto-2-methyl-2-pyrroline-3-carboxylic acid ethyl ester Formula: C17H19NO5 MolecularWeight: 317.33646

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=CC2=C(C=CC=C2OC)OC)C1=O)C

Isomeric SMILES

CCOC(=O)C1=C(N/C(=C/C2=C(C=CC=C2OC)OC)/C1=O)C

InChI

InChI=1S/C17H19NO5/c1-5-23-17(20)15-10(2)18-12(16(15)19)9-11-13(21-3)7-6-8-14(11)22-4/h6-9,18H,5H2,1-4H3/b12-9+