[4-[3-cyano-2-isocyano-4-(oxiran-2-ylcarbonyloxymethyl)phenoxy]carbonylphenyl]methyl oxirane-2-carboxylate

Systemtic Name: [4-[3-cyano-2-isocyano-4-(oxiran-2-ylcarbonyloxymethyl)phenoxy]carbonylphenyl]methyl oxirane-2-carboxylate Openeye Name: [4-[3-cyano-2-isocyano-4-(oxirane-2-carbonyloxymethyl)phenoxy]carbonylphenyl]methyl oxirane-2-carboxylate CAS Name: 2-oxiranecarboxylic acid [4-[[3-cyano-2-isocyano-4-[[2-oxiranyl(oxo)methoxy]methyl]phenoxy]-oxomethyl]phenyl]methyl ester IUPAC Name: [4-[3-cyano-2-isocyano-4-(oxirane-2-carbonyloxymethyl)phenoxy]carbonylphenyl]methyl oxirane-2-carboxylate Traditional Name: oxirane-2-carboxylic acid [4-[3-cyano-2-isocyano-4-(oxirane-2-carbonyloxymethyl)phenoxy]carbonylbenzyl] ester Formula: C23H16N2O8 MolecularWeight: 448.38174

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=C(C=CC(=C1C#N)COC(=O)C2CO2)OC(=O)C3=CC=C(C=C3)COC(=O)C4CO4

Isomeric SMILES

[C-]#[N+]C1=C(C=CC(=C1C#N)COC(=O)C2CO2)OC(=O)C3=CC=C(C=C3)COC(=O)C4CO4

InChI

InChI=1S/C23H16N2O8/c1-25-20-16(8-24)15(10-32-23(28)19-12-30-19)6-7-17(20)33-21(26)14-4-2-13(3-5-14)9-31-22(27)18-11-29-18/h2-7,18-19H,9-12H2