[4-[4-cyano-2,3-bis(fluoranyl)phenoxy]carbonylphenyl] 4-pentoxybenzoate

Systemtic Name: [4-[4-cyano-2,3-bis(fluoranyl)phenoxy]carbonylphenyl] 4-pentoxybenzoate Openeye Name: [4-(4-cyano-2,3-difluoro-phenoxy)carbonylphenyl] 4-pentoxybenzoate CAS Name: 4-pentoxybenzoic acid [4-[(4-cyano-2,3-difluorophenoxy)-oxomethyl]phenyl] ester IUPAC Name: [4-(4-cyano-2,3-difluorophenoxy)carbonylphenyl] 4-pentoxybenzoate Traditional Name: 4-amoxybenzoic acid [4-(4-cyano-2,3-difluoro-phenoxy)carbonylphenyl] ester Formula: C26H21F2NO5 MolecularWeight: 465.445446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC3=C(C(=C(C=C3)C#N)F)F

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC3=C(C(=C(C=C3)C#N)F)F

InChI

InChI=1S/C26H21F2NO5/c1-2-3-4-15-32-20-10-5-17(6-11-20)25(30)33-21-12-7-18(8-13-21)26(31)34-22-14-9-19(16-29)23(27)24(22)28/h5-14H,2-4,15H2,1H3