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

Systemtic Name: 6-azanylidene-1-methyl-8-phenyl-3-undecyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Openeye Name: 6-imino-1-methyl-8-phenyl-3-undecyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile CAS Name: 6-imino-1-methyl-8-phenyl-3-undecyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile IUPAC Name: 6-imino-1-methyl-8-phenyl-3-undecyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Traditional Name: 6-imino-1-methyl-8-phenyl-3-undecyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Formula: C27H34N4O2 MolecularWeight: 446.58446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1C(C2(C(C(O1)(OC2=N)C)C3=CC=CC=C3)C#N)(C#N)C#N

Isomeric SMILES

CCCCCCCCCCCC1C(C2(C(C(O1)(OC2=N)C)C3=CC=CC=C3)C#N)(C#N)C#N

InChI

InChI=1S/C27H34N4O2/c1-3-4-5-6-7-8-9-10-14-17-22-26(18-28,19-29)27(20-30)23(21-15-12-11-13-16-21)25(2,32-22)33-24(27)31/h11-13,15-16,22-23,31H,3-10,14,17H2,1-2H3