6-azanylidene-8-(2-methoxyphenyl)-1-methyl-3-pentyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile

Systemtic Name: 6-azanylidene-8-(2-methoxyphenyl)-1-methyl-3-pentyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Openeye Name: 6-imino-8-(2-methoxyphenyl)-1-methyl-3-pentyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile CAS Name: 6-imino-8-(2-methoxyphenyl)-1-methyl-3-pentyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile IUPAC Name: 6-imino-8-(2-methoxyphenyl)-1-methyl-3-pentyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Traditional Name: 3-amyl-6-imino-8-(2-methoxyphenyl)-1-methyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Formula: C22H24N4O3 MolecularWeight: 392.45096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C(C2(C(C(O1)(OC2=N)C)C3=CC=CC=C3OC)C#N)(C#N)C#N

Isomeric SMILES

CCCCCC1C(C2(C(C(O1)(OC2=N)C)C3=CC=CC=C3OC)C#N)(C#N)C#N

InChI

InChI=1S/C22H24N4O3/c1-4-5-6-11-17-21(12-23,13-24)22(14-25)18(20(2,28-17)29-19(22)26)15-9-7-8-10-16(15)27-3/h7-10,17-18,26H,4-6,11H2,1-3H3