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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2(C(=N)OC1(OC(C2(C#N)C#N)CCC3=CC=CC=C3)C4=CC=C(C=C4)OC)C#N

Isomeric SMILES

CC1C2(C(=N)OC1(OC(C2(C#N)C#N)CCC3=CC=CC=C3)C4=CC=C(C=C4)OC)C#N

InChI

InChI=1S/C25H22N4O3/c1-17-24(16-28)22(29)32-25(17,19-9-11-20(30-2)12-10-19)31-21(23(24,14-26)15-27)13-8-18-6-4-3-5-7-18/h3-7,9-12,17,21,29H,8,13H2,1-2H3