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

Systemtic Name: 7-azanylidene-3-heptyl-5-(4-methoxyphenyl)-8-methyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Openeye Name: 3-heptyl-7-imino-5-(4-methoxyphenyl)-8-methyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile CAS Name: 3-heptyl-7-imino-5-(4-methoxyphenyl)-8-methyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile IUPAC Name: 3-heptyl-7-imino-5-(4-methoxyphenyl)-8-methyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Traditional Name: 3-heptyl-7-imino-5-(4-methoxyphenyl)-8-methyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Formula: C24H28N4O3 MolecularWeight: 420.50412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C(C2(C(C(O1)(OC2=N)C3=CC=C(C=C3)OC)C)C#N)(C#N)C#N

Isomeric SMILES

CCCCCCCC1C(C2(C(C(O1)(OC2=N)C3=CC=C(C=C3)OC)C)C#N)(C#N)C#N

InChI

InChI=1S/C24H28N4O3/c1-4-5-6-7-8-9-20-22(14-25,15-26)23(16-27)17(2)24(30-20,31-21(23)28)18-10-12-19(29-3)13-11-18/h10-13,17,20,28H,4-9H2,1-3H3