ethyl 4-[3-ethanoyl-2-(3-ethoxy-4-oxidanyl-phenyl)-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]benzoate

Systemtic Name: ethyl 4-[3-ethanoyl-2-(3-ethoxy-4-oxidanyl-phenyl)-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]benzoate Openeye Name: ethyl 4-[3-acetyl-2-(3-ethoxy-4-hydroxy-phenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]benzoate CAS Name: 4-[3-acetyl-2-(3-ethoxy-4-hydroxyphenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-acetyl-2-(3-ethoxy-4-hydroxyphenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]benzoate Traditional Name: 4-[3-acetyl-2-(3-ethoxy-4-hydroxy-phenyl)-4-hydroxy-5-keto-3-pyrrolin-1-yl]benzoic acid ethyl ester Formula: C23H23NO7 MolecularWeight: 425.43122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(C(=O)N2C3=CC=C(C=C3)C(=O)OCC)O)C(=O)C)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(=C(C(=O)N2C3=CC=C(C=C3)C(=O)OCC)O)C(=O)C)O

InChI

InChI=1S/C23H23NO7/c1-4-30-18-12-15(8-11-17(18)26)20-19(13(3)25)21(27)22(28)24(20)16-9-6-14(7-10-16)23(29)31-5-2/h6-12,20,26-27H,4-5H2,1-3H3