7-[4-(4-cyanophenyl)phenyl]heptyl oxirane-2-carboxylate

Systemtic Name: 7-[4-(4-cyanophenyl)phenyl]heptyl oxirane-2-carboxylate Openeye Name: 7-[4-(4-cyanophenyl)phenyl]heptyl oxirane-2-carboxylate CAS Name: 2-oxiranecarboxylic acid 7-[4-(4-cyanophenyl)phenyl]heptyl ester IUPAC Name: 7-[4-(4-cyanophenyl)phenyl]heptyl oxirane-2-carboxylate Traditional Name: oxirane-2-carboxylic acid 7-[4-(4-cyanophenyl)phenyl]heptyl ester Formula: C23H25NO3 MolecularWeight: 363.4495

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Descriptors Computed from Structure

Canonical SMILES:

C1C(O1)C(=O)OCCCCCCCC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1C(O1)C(=O)OCCCCCCCC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H25NO3/c24-16-19-9-13-21(14-10-19)20-11-7-18(8-12-20)6-4-2-1-3-5-15-26-23(25)22-17-27-22/h7-14,22H,1-6,15,17H2