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

Systemtic Name: 2-[2-(3-methoxy-4-oxidanyl-phenyl)-4,5-bis(oxidanylidene)-3-(phenylcarbonyl)pyrrolidin-1-yl]ethanenitrile Openeye Name: 2-[3-benzoyl-2-(4-hydroxy-3-methoxy-phenyl)-4,5-dioxo-pyrrolidin-1-yl]acetonitrile CAS Name: 2-[3-benzoyl-2-(4-hydroxy-3-methoxyphenyl)-4,5-dioxo-1-pyrrolidinyl]acetonitrile IUPAC Name: 2-[3-benzoyl-2-(4-hydroxy-3-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]acetonitrile Traditional Name: 2-[3-benzoyl-2-(4-hydroxy-3-methoxy-phenyl)-4,5-diketo-pyrrolidino]acetonitrile Formula: C20H16N2O5 MolecularWeight: 364.35144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C(C(=O)C(=O)N2CC#N)C(=O)C3=CC=CC=C3)O

Isomeric SMILES

COC1=C(C=CC(=C1)C2C(C(=O)C(=O)N2CC#N)C(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C20H16N2O5/c1-27-15-11-13(7-8-14(15)23)17-16(18(24)12-5-3-2-4-6-12)19(25)20(26)22(17)10-9-21/h2-8,11,16-17,23H,10H2,1H3