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

Systemtic Name: 7-azanylidene-3-hexyl-5-(4-methoxyphenyl)-8-methyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Openeye Name: 3-hexyl-7-imino-5-(4-methoxyphenyl)-8-methyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile CAS Name: 3-hexyl-7-imino-5-(4-methoxyphenyl)-8-methyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile IUPAC Name: 3-hexyl-7-imino-5-(4-methoxyphenyl)-8-methyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Traditional Name: 3-hexyl-7-imino-5-(4-methoxyphenyl)-8-methyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(C2(C(C(O1)(OC2=N)C3=CC=C(C=C3)OC)C)C#N)(C#N)C#N

Isomeric SMILES

CCCCCCC1C(C2(C(C(O1)(OC2=N)C3=CC=C(C=C3)OC)C)C#N)(C#N)C#N

InChI

InChI=1S/C23H26N4O3/c1-4-5-6-7-8-19-21(13-24,14-25)22(15-26)16(2)23(29-19,30-20(22)27)17-9-11-18(28-3)12-10-17/h9-12,16,19,27H,4-8H2,1-3H3