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

Systemtic Name: 6-azanylidene-1-methyl-8-phenyl-3-(4-propoxyphenyl)-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Openeye Name: 6-imino-1-methyl-8-phenyl-3-(4-propoxyphenyl)-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile CAS Name: 6-imino-1-methyl-8-phenyl-3-(4-propoxyphenyl)-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile IUPAC Name: 6-imino-1-methyl-8-phenyl-3-(4-propoxyphenyl)-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Traditional Name: 6-imino-1-methyl-8-phenyl-3-(4-propoxyphenyl)-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Formula: C25H22N4O3 MolecularWeight: 426.46718

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2C(C3(C(C(O2)(OC3=N)C)C4=CC=CC=C4)C#N)(C#N)C#N

Isomeric SMILES

CCCOC1=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/C25H22N4O3/c1-3-13-30-19-11-9-18(10-12-19)21-24(14-26,15-27)25(16-28)20(17-7-5-4-6-8-17)23(2,31-21)32-22(25)29/h4-12,20-21,29H,3,13H2,1-2H3