(4-cyanophenyl) 4-(4-decylcyclohexa-1,3-dien-1-yl)-2,6-bis(fluoranyl)benzoate

Systemtic Name: (4-cyanophenyl) 4-(4-decylcyclohexa-1,3-dien-1-yl)-2,6-bis(fluoranyl)benzoate Openeye Name: (4-cyanophenyl) 4-(4-decylcyclohexa-1,3-dien-1-yl)-2,6-difluoro-benzoate CAS Name: 4-(4-decyl-1-cyclohexa-1,3-dienyl)-2,6-difluorobenzoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 4-(4-decylcyclohexa-1,3-dien-1-yl)-2,6-difluorobenzoate Traditional Name: 4-(4-decylcyclohexa-1,3-dien-1-yl)-2,6-difluoro-benzoic acid (4-cyanophenyl) ester Formula: C30H33F2NO2 MolecularWeight: 477.585326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC=C(CC1)C2=CC(=C(C(=C2)F)C(=O)OC3=CC=C(C=C3)C#N)F

Isomeric SMILES

CCCCCCCCCCC1=CC=C(CC1)C2=CC(=C(C(=C2)F)C(=O)OC3=CC=C(C=C3)C#N)F

InChI

InChI=1S/C30H33F2NO2/c1-2-3-4-5-6-7-8-9-10-22-11-15-24(16-12-22)25-19-27(31)29(28(32)20-25)30(34)35-26-17-13-23(21-33)14-18-26/h11,13-15,17-20H,2-10,12,16H2,1H3