ethyl 5-[(3-ethoxy-4-propoxy-phenyl)methyl]-2-methyl-4-oxidanylidene-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[(3-ethoxy-4-propoxy-phenyl)methyl]-2-methyl-4-oxidanylidene-pyrrole-3-carboxylate Openeye Name: ethyl 5-[(3-ethoxy-4-propoxy-phenyl)methyl]-2-methyl-4-oxo-pyrrole-3-carboxylate CAS Name: 5-[(3-ethoxy-4-propoxyphenyl)methyl]-2-methyl-4-oxo-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(3-ethoxy-4-propoxyphenyl)methyl]-2-methyl-4-oxopyrrole-3-carboxylate Traditional Name: 5-(3-ethoxy-4-propoxy-benzyl)-4-keto-2-methyl-pyrrole-3-carboxylic acid ethyl ester Formula: C20H25NO5 MolecularWeight: 359.4162

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)CC2=NC(=C(C2=O)C(=O)OCC)C)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)CC2=NC(=C(C2=O)C(=O)OCC)C)OCC

InChI

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