2,3-dimethyl-4-(3-oxidanylidenebutyl)-5-[4-(3-oxidanylidenebutyl)phenyl]benzenecarbonitrile

Systemtic Name: 2,3-dimethyl-4-(3-oxidanylidenebutyl)-5-[4-(3-oxidanylidenebutyl)phenyl]benzenecarbonitrile Openeye Name: 2,3-dimethyl-4-(3-oxobutyl)-5-[4-(3-oxobutyl)phenyl]benzonitrile CAS Name: 2,3-dimethyl-4-(3-oxobutyl)-5-[4-(3-oxobutyl)phenyl]benzonitrile IUPAC Name: 2,3-dimethyl-4-(3-oxobutyl)-5-[4-(3-oxobutyl)phenyl]benzonitrile Traditional Name: 4-(3-ketobutyl)-5-[4-(3-ketobutyl)phenyl]-2,3-dimethyl-benzonitrile Formula: C23H25NO2 MolecularWeight: 347.4501

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1C#N)C2=CC=C(C=C2)CCC(=O)C)CCC(=O)C)C

Isomeric SMILES

CC1=C(C(=C(C=C1C#N)C2=CC=C(C=C2)CCC(=O)C)CCC(=O)C)C

InChI

InChI=1S/C23H25NO2/c1-15(25)5-7-19-8-10-20(11-9-19)23-13-21(14-24)17(3)18(4)22(23)12-6-16(2)26/h8-11,13H,5-7,12H2,1-4H3