4-chloranyl-5-[(5-methyl-2-octoxy-phenyl)methyl]benzene-1,2-dicarbonitrile

Systemtic Name: 4-chloranyl-5-[(5-methyl-2-octoxy-phenyl)methyl]benzene-1,2-dicarbonitrile Openeye Name: 4-chloro-5-[(5-methyl-2-octoxy-phenyl)methyl]phthalonitrile CAS Name: 4-chloro-5-[(5-methyl-2-octoxyphenyl)methyl]benzene-1,2-dicarbonitrile IUPAC Name: 4-chloro-5-[(5-methyl-2-octoxyphenyl)methyl]benzene-1,2-dicarbonitrile Traditional Name: 4-chloro-5-(5-methyl-2-octoxy-benzyl)phthalonitrile Formula: C24H27ClN2O MolecularWeight: 394.93698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)C)CC2=C(C=C(C(=C2)C#N)C#N)Cl

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)C)CC2=C(C=C(C(=C2)C#N)C#N)Cl

InChI

InChI=1S/C24H27ClN2O/c1-3-4-5-6-7-8-11-28-24-10-9-18(2)12-20(24)13-19-14-21(16-26)22(17-27)15-23(19)25/h9-10,12,14-15H,3-8,11,13H2,1-2H3