4,5-bis(4-cyanophenoxy)-3-(2,6-dibutyl-4-methyl-phenoxy)-6-fluoranyl-benzene-1,2-dicarbonitrile

Systemtic Name: 4,5-bis(4-cyanophenoxy)-3-(2,6-dibutyl-4-methyl-phenoxy)-6-fluoranyl-benzene-1,2-dicarbonitrile Openeye Name: 4,5-bis(4-cyanophenoxy)-3-(2,6-dibutyl-4-methyl-phenoxy)-6-fluoro-phthalonitrile CAS Name: 4,5-bis(4-cyanophenoxy)-3-(2,6-dibutyl-4-methylphenoxy)-6-fluorobenzene-1,2-dicarbonitrile IUPAC Name: 4,5-bis(4-cyanophenoxy)-3-(2,6-dibutyl-4-methylphenoxy)-6-fluorobenzene-1,2-dicarbonitrile Traditional Name: 4,5-bis(4-cyanophenoxy)-3-(2,6-dibutyl-4-methyl-phenoxy)-6-fluoro-phthalonitrile Formula: C37H31FN4O3 MolecularWeight: 598.665443

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=CC(=C1OC2=C(C(=C(C(=C2C#N)C#N)F)OC3=CC=C(C=C3)C#N)OC4=CC=C(C=C4)C#N)CCCC)C

Isomeric SMILES

CCCCC1=CC(=CC(=C1OC2=C(C(=C(C(=C2C#N)C#N)F)OC3=CC=C(C=C3)C#N)OC4=CC=C(C=C4)C#N)CCCC)C

InChI

InChI=1S/C37H31FN4O3/c1-4-6-8-27-18-24(3)19-28(9-7-5-2)34(27)45-35-32(23-42)31(22-41)33(38)36(43-29-14-10-25(20-39)11-15-29)37(35)44-30-16-12-26(21-40)13-17-30/h10-19H,4-9H2,1-3H3