4-(4-butoxyphenyl)-1-(3-oxidanylidenecyclohexyl)cyclohexane-1-carbonitrile

Systemtic Name: 4-(4-butoxyphenyl)-1-(3-oxidanylidenecyclohexyl)cyclohexane-1-carbonitrile Openeye Name: 4-(4-butoxyphenyl)-1-(3-oxocyclohexyl)cyclohexanecarbonitrile CAS Name: 4-(4-butoxyphenyl)-1-(3-oxocyclohexyl)-1-cyclohexanecarbonitrile IUPAC Name: 4-(4-butoxyphenyl)-1-(3-oxocyclohexyl)cyclohexane-1-carbonitrile Traditional Name: 4-(4-butoxyphenyl)-1-(3-ketocyclohexyl)cyclohexanecarbonitrile Formula: C23H31NO2 MolecularWeight: 353.49774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2CCC(CC2)(C#N)C3CCCC(=O)C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2CCC(CC2)(C#N)C3CCCC(=O)C3

InChI

InChI=1S/C23H31NO2/c1-2-3-15-26-22-9-7-18(8-10-22)19-11-13-23(17-24,14-12-19)20-5-4-6-21(25)16-20/h7-10,19-20H,2-6,11-16H2,1H3