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

Systemtic Name: 7-azanylidene-5-(4-bromophenyl)-8-methyl-3-phenethyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Openeye Name: 5-(4-bromophenyl)-7-imino-8-methyl-3-phenethyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile CAS Name: 5-(4-bromophenyl)-7-imino-8-methyl-3-phenethyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile IUPAC Name: 5-(4-bromophenyl)-7-imino-8-methyl-3-phenethyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Traditional Name: 5-(4-bromophenyl)-7-imino-8-methyl-3-phenethyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Formula: C24H19BrN4O2 MolecularWeight: 475.33726

Click to see the large picture

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)Br)C#N

Isomeric SMILES

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

InChI

InChI=1S/C24H19BrN4O2/c1-16-23(15-28)21(29)31-24(16,18-8-10-19(25)11-9-18)30-20(22(23,13-26)14-27)12-7-17-5-3-2-4-6-17/h2-6,8-11,16,20,29H,7,12H2,1H3