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

Systemtic Name: 6-azanylidene-3-(4-hexoxyphenyl)-1-methyl-8-phenyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Openeye Name: 3-(4-hexoxyphenyl)-6-imino-1-methyl-8-phenyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile CAS Name: 3-(4-hexoxyphenyl)-6-imino-1-methyl-8-phenyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile IUPAC Name: 3-(4-hexoxyphenyl)-6-imino-1-methyl-8-phenyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Traditional Name: 3-(4-hexoxyphenyl)-6-imino-1-methyl-8-phenyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Formula: C28H28N4O3 MolecularWeight: 468.54692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2C(C3(C(C(O2)(OC3=N)C)C4=CC=CC=C4)C#N)(C#N)C#N

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2C(C3(C(C(O2)(OC3=N)C)C4=CC=CC=C4)C#N)(C#N)C#N

InChI

InChI=1S/C28H28N4O3/c1-3-4-5-9-16-33-22-14-12-21(13-15-22)24-27(17-29,18-30)28(19-31)23(20-10-7-6-8-11-20)26(2,34-24)35-25(28)32/h6-8,10-15,23-24,32H,3-5,9,16H2,1-2H3