6-methyl-2-[4-(2-methylpropoxy)phenyl]-3-oxidanylidene-heptanenitrile

Systemtic Name: 6-methyl-2-[4-(2-methylpropoxy)phenyl]-3-oxidanylidene-heptanenitrile Openeye Name: 2-(4-isobutoxyphenyl)-6-methyl-3-oxo-heptanenitrile CAS Name: 6-methyl-2-[4-(2-methylpropoxy)phenyl]-3-oxoheptanenitrile IUPAC Name: 6-methyl-2-[4-(2-methylpropoxy)phenyl]-3-oxoheptanenitrile Traditional Name: 2-(4-isobutoxyphenyl)-3-keto-6-methyl-enanthonitrile Formula: C18H25NO2 MolecularWeight: 287.3966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)C(C#N)C1=CC=C(C=C1)OCC(C)C

Isomeric SMILES

CC(C)CCC(=O)C(C#N)C1=CC=C(C=C1)OCC(C)C

InChI

InChI=1S/C18H25NO2/c1-13(2)5-10-18(20)17(11-19)15-6-8-16(9-7-15)21-12-14(3)4/h6-9,13-14,17H,5,10,12H2,1-4H3