7-[4-[3-cyano-2-isocyano-4-[5-(oxiran-2-ylcarbonyloxy)pentoxy]phenoxy]carbonylphenyl]heptyl oxirane-2-carboxylate

Systemtic Name: 7-[4-[3-cyano-2-isocyano-4-[5-(oxiran-2-ylcarbonyloxy)pentoxy]phenoxy]carbonylphenyl]heptyl oxirane-2-carboxylate Openeye Name: 7-[4-[3-cyano-2-isocyano-4-[5-(oxirane-2-carbonyloxy)pentoxy]phenoxy]carbonylphenyl]heptyl oxirane-2-carboxylate CAS Name: 2-oxiranecarboxylic acid 7-[4-[[3-cyano-2-isocyano-4-[5-[2-oxiranyl(oxo)methoxy]pentoxy]phenoxy]-oxomethyl]phenyl]heptyl ester IUPAC Name: 7-[4-[3-cyano-2-isocyano-4-[5-(oxirane-2-carbonyloxy)pentoxy]phenoxy]carbonylphenyl]heptyl oxirane-2-carboxylate Traditional Name: oxirane-2-carboxylic acid 7-[4-[3-cyano-2-isocyano-4-[5-(oxirane-2-carbonyloxy)pentoxy]phenoxy]carbonylphenyl]heptyl ester Formula: C33H36N2O9 MolecularWeight: 604.64694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H36N2O9/c1-35-30-25(20-34)26(39-17-8-5-9-19-41-33(38)29-22-43-29)15-16-27(30)44-31(36)24-13-11-23(12-14-24)10-6-3-2-4-7-18-40-32(37)28-21-42-28/h11-16,28-29H,2-10,17-19,21-22H2