3-[3-methanoyl-1-(3-methoxyphenyl)-2-oxidanylidene-cyclohexyl]propanenitrile

Systemtic Name: 3-[3-methanoyl-1-(3-methoxyphenyl)-2-oxidanylidene-cyclohexyl]propanenitrile Openeye Name: 3-[3-formyl-1-(3-methoxyphenyl)-2-oxo-cyclohexyl]propanenitrile CAS Name: 3-[3-formyl-1-(3-methoxyphenyl)-2-oxocyclohexyl]propanenitrile IUPAC Name: 3-[3-formyl-1-(3-methoxyphenyl)-2-oxocyclohexyl]propanenitrile Traditional Name: 3-[3-formyl-2-keto-1-(3-methoxyphenyl)cyclohexyl]propionitrile Formula: C17H19NO3 MolecularWeight: 285.33766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2(CCCC(C2=O)C=O)CCC#N

Isomeric SMILES

COC1=CC=CC(=C1)C2(CCCC(C2=O)C=O)CCC#N

InChI

InChI=1S/C17H19NO3/c1-21-15-7-2-6-14(11-15)17(9-4-10-18)8-3-5-13(12-19)16(17)20/h2,6-7,11-13H,3-5,8-9H2,1H3