4-[4-(4-butoxyphenyl)phenyl]-1-(3-oxidanylidenecyclohexyl)cyclohexane-1-carbonitrile

Systemtic Name: 4-[4-(4-butoxyphenyl)phenyl]-1-(3-oxidanylidenecyclohexyl)cyclohexane-1-carbonitrile Openeye Name: 4-[4-(4-butoxyphenyl)phenyl]-1-(3-oxocyclohexyl)cyclohexanecarbonitrile CAS Name: 4-[4-(4-butoxyphenyl)phenyl]-1-(3-oxocyclohexyl)-1-cyclohexanecarbonitrile IUPAC Name: 4-[4-(4-butoxyphenyl)phenyl]-1-(3-oxocyclohexyl)cyclohexane-1-carbonitrile Traditional Name: 4-[4-(4-butoxyphenyl)phenyl]-1-(3-ketocyclohexyl)cyclohexanecarbonitrile Formula: C29H35NO2 MolecularWeight: 429.5937

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)(C#N)C4CCCC(=O)C4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)(C#N)C4CCCC(=O)C4

InChI

InChI=1S/C29H35NO2/c1-2-3-19-32-28-13-11-24(12-14-28)22-7-9-23(10-8-22)25-15-17-29(21-30,18-16-25)26-5-4-6-27(31)20-26/h7-14,25-26H,2-6,15-20H2,1H3