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

Systemtic Name: 6-azanylidene-8-ethyl-1-methyl-3-(4-propoxyphenyl)-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Openeye Name: 8-ethyl-6-imino-1-methyl-3-(4-propoxyphenyl)-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile CAS Name: 8-ethyl-6-imino-1-methyl-3-(4-propoxyphenyl)-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile IUPAC Name: 8-ethyl-6-imino-1-methyl-3-(4-propoxyphenyl)-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Traditional Name: 8-ethyl-6-imino-1-methyl-3-(4-propoxyphenyl)-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Formula: C21H22N4O3 MolecularWeight: 378.42438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2C(C3(C(C(O2)(OC3=N)C)CC)C#N)(C#N)C#N

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2C(C3(C(C(O2)(OC3=N)C)CC)C#N)(C#N)C#N

InChI

InChI=1S/C21H22N4O3/c1-4-10-26-15-8-6-14(7-9-15)17-20(11-22,12-23)21(13-24)16(5-2)19(3,27-17)28-18(21)25/h6-9,16-17,25H,4-5,10H2,1-3H3