7-[4-[4-[4-(oxiran-2-yl)butoxy]phenyl]phenyl]heptyl oxirane-2-carboxylate

Systemtic Name: 7-[4-[4-[4-(oxiran-2-yl)butoxy]phenyl]phenyl]heptyl oxirane-2-carboxylate Openeye Name: 7-[4-[4-[4-(oxiran-2-yl)butoxy]phenyl]phenyl]heptyl oxirane-2-carboxylate CAS Name: 2-oxiranecarboxylic acid 7-[4-[4-[4-(2-oxiranyl)butoxy]phenyl]phenyl]heptyl ester IUPAC Name: 7-[4-[4-[4-(oxiran-2-yl)butoxy]phenyl]phenyl]heptyl oxirane-2-carboxylate Traditional Name: oxirane-2-carboxylic acid 7-[4-[4-[4-(oxiran-2-yl)butoxy]phenyl]phenyl]heptyl ester Formula: C28H36O5 MolecularWeight: 452.58244

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Descriptors Computed from Structure

Canonical SMILES:

C1C(O1)CCCCOC2=CC=C(C=C2)C3=CC=C(C=C3)CCCCCCCOC(=O)C4CO4

Isomeric SMILES

C1C(O1)CCCCOC2=CC=C(C=C2)C3=CC=C(C=C3)CCCCCCCOC(=O)C4CO4

InChI

InChI=1S/C28H36O5/c29-28(27-21-33-27)31-19-6-3-1-2-4-8-22-10-12-23(13-11-22)24-14-16-25(17-15-24)30-18-7-5-9-26-20-32-26/h10-17,26-27H,1-9,18-21H2