2-[2-(3-ethoxy-4-oxidanyl-phenyl)-4,5-bis(oxidanylidene)-3-(phenylcarbonyl)pyrrolidin-1-yl]ethanenitrile

Systemtic Name: 2-[2-(3-ethoxy-4-oxidanyl-phenyl)-4,5-bis(oxidanylidene)-3-(phenylcarbonyl)pyrrolidin-1-yl]ethanenitrile Openeye Name: 2-[3-benzoyl-2-(3-ethoxy-4-hydroxy-phenyl)-4,5-dioxo-pyrrolidin-1-yl]acetonitrile CAS Name: 2-[3-benzoyl-2-(3-ethoxy-4-hydroxyphenyl)-4,5-dioxo-1-pyrrolidinyl]acetonitrile IUPAC Name: 2-[3-benzoyl-2-(3-ethoxy-4-hydroxyphenyl)-4,5-dioxopyrrolidin-1-yl]acetonitrile Traditional Name: 2-[3-benzoyl-2-(3-ethoxy-4-hydroxy-phenyl)-4,5-diketo-pyrrolidino]acetonitrile Formula: C21H18N2O5 MolecularWeight: 378.37802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(C(=O)C(=O)N2CC#N)C(=O)C3=CC=CC=C3)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(C(=O)C(=O)N2CC#N)C(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C21H18N2O5/c1-2-28-16-12-14(8-9-15(16)24)18-17(19(25)13-6-4-3-5-7-13)20(26)21(27)23(18)11-10-22/h3-9,12,17-18,24H,2,11H2,1H3