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

Systemtic Name: 1-(3-oxidanylidenecyclohexyl)-4-[4-(4-pentoxyphenyl)phenyl]cyclohexane-1-carbonitrile Openeye Name: 1-(3-oxocyclohexyl)-4-[4-(4-pentoxyphenyl)phenyl]cyclohexanecarbonitrile CAS Name: 1-(3-oxocyclohexyl)-4-[4-(4-pentoxyphenyl)phenyl]-1-cyclohexanecarbonitrile IUPAC Name: 1-(3-oxocyclohexyl)-4-[4-(4-pentoxyphenyl)phenyl]cyclohexane-1-carbonitrile Traditional Name: 4-[4-(4-amoxyphenyl)phenyl]-1-(3-ketocyclohexyl)cyclohexanecarbonitrile Formula: C30H37NO2 MolecularWeight: 443.62028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)(C#N)C4CCCC(=O)C4

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)(C#N)C4CCCC(=O)C4

InChI

InChI=1S/C30H37NO2/c1-2-3-4-20-33-29-14-12-25(13-15-29)23-8-10-24(11-9-23)26-16-18-30(22-31,19-17-26)27-6-5-7-28(32)21-27/h8-15,26-27H,2-7,16-21H2,1H3