(2Z)-2-[7-(4,8-dimethyl-5-oxidanylidene-non-7-enyl)-7-methyl-6-oxidanylidene-oxepan-3-ylidene]ethanenitrile

Systemtic Name: (2Z)-2-[7-(4,8-dimethyl-5-oxidanylidene-non-7-enyl)-7-methyl-6-oxidanylidene-oxepan-3-ylidene]ethanenitrile Openeye Name: (2Z)-2-[7-(4,8-dimethyl-5-oxo-non-7-enyl)-7-methyl-6-oxo-oxepan-3-ylidene]acetonitrile CAS Name: (2Z)-2-[7-(4,8-dimethyl-5-oxonon-7-enyl)-7-methyl-6-oxo-3-oxepanylidene]acetonitrile IUPAC Name: (2Z)-2-[7-(4,8-dimethyl-5-oxonon-7-enyl)-7-methyl-6-oxooxepan-3-ylidene]acetonitrile Traditional Name: (2Z)-2-[6-keto-7-(5-keto-4,8-dimethyl-non-7-enyl)-7-methyl-oxepan-3-ylidene]acetonitrile Formula: C20H29NO3 MolecularWeight: 331.44916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1(C(=O)CCC(=CC#N)CO1)C)C(=O)CC=C(C)C

Isomeric SMILES

CC(CCCC1(C(=O)CC/C(=C/C#N)/CO1)C)C(=O)CC=C(C)C

InChI

InChI=1S/C20H29NO3/c1-15(2)7-9-18(22)16(3)6-5-12-20(4)19(23)10-8-17(11-13-21)14-24-20/h7,11,16H,5-6,8-10,12,14H2,1-4H3/b17-11-