1-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]-4-oxidanylidene-cyclohexane-1-carbonitrile

Systemtic Name: 1-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]-4-oxidanylidene-cyclohexane-1-carbonitrile Openeye Name: 1-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]-4-oxo-cyclohexanecarbonitrile CAS Name: 1-[3-(cyclopropylmethoxy)-4-methoxyphenyl]-4-oxo-1-cyclohexanecarbonitrile IUPAC Name: 1-[3-(cyclopropylmethoxy)-4-methoxyphenyl]-4-oxocyclohexane-1-carbonitrile Traditional Name: 1-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]-4-keto-cyclohexanecarbonitrile Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCC(=O)CC2)C#N)OCC3CC3

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCC(=O)CC2)C#N)OCC3CC3

InChI

InChI=1S/C18H21NO3/c1-21-16-5-4-14(10-17(16)22-11-13-2-3-13)18(12-19)8-6-15(20)7-9-18/h4-5,10,13H,2-3,6-9,11H2,1H3