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

Systemtic Name: 7-azanylidene-5-(4-methoxyphenyl)-8-methyl-3-(4-nitrophenyl)-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Openeye Name: 7-imino-5-(4-methoxyphenyl)-8-methyl-3-(4-nitrophenyl)-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile CAS Name: 7-imino-5-(4-methoxyphenyl)-8-methyl-3-(4-nitrophenyl)-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile IUPAC Name: 7-imino-5-(4-methoxyphenyl)-8-methyl-3-(4-nitrophenyl)-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Traditional Name: 7-imino-5-(4-methoxyphenyl)-8-methyl-3-(4-nitrophenyl)-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Formula: C23H17N5O5 MolecularWeight: 443.41158

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2(C(=N)OC1(OC(C2(C#N)C#N)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)OC)C#N

Isomeric SMILES

CC1C2(C(=N)OC1(OC(C2(C#N)C#N)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)OC)C#N

InChI

InChI=1S/C23H17N5O5/c1-14-22(13-26)20(27)33-23(14,16-5-9-18(31-2)10-6-16)32-19(21(22,11-24)12-25)15-3-7-17(8-4-15)28(29)30/h3-10,14,19,27H,1-2H3