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

Systemtic Name: 1-(3-oxidanylidenecyclohexyl)-4-[4-(4-pentylphenyl)phenyl]cyclohexane-1-carbonitrile Openeye Name: 1-(3-oxocyclohexyl)-4-[4-(4-pentylphenyl)phenyl]cyclohexanecarbonitrile CAS Name: 1-(3-oxocyclohexyl)-4-[4-(4-pentylphenyl)phenyl]-1-cyclohexanecarbonitrile IUPAC Name: 1-(3-oxocyclohexyl)-4-[4-(4-pentylphenyl)phenyl]cyclohexane-1-carbonitrile Traditional Name: 4-[4-(4-amylphenyl)phenyl]-1-(3-ketocyclohexyl)cyclohexanecarbonitrile Formula: C30H37NO MolecularWeight: 427.62088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)(C#N)C4CCCC(=O)C4

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)(C#N)C4CCCC(=O)C4

InChI

InChI=1S/C30H37NO/c1-2-3-4-6-23-9-11-24(12-10-23)25-13-15-26(16-14-25)27-17-19-30(22-31,20-18-27)28-7-5-8-29(32)21-28/h9-16,27-28H,2-8,17-21H2,1H3