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

Systemtic Name: 7-azanylidene-8-methyl-5-phenyl-3-(3-phenylmethoxyphenyl)-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Openeye Name: 3-(3-benzyloxyphenyl)-7-imino-8-methyl-5-phenyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile CAS Name: 7-imino-8-methyl-5-phenyl-3-(3-phenylmethoxyphenyl)-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile IUPAC Name: 7-imino-8-methyl-5-phenyl-3-(3-phenylmethoxyphenyl)-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Traditional Name: 3-(3-benzoxyphenyl)-7-imino-8-methyl-5-phenyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Formula: C29H22N4O3 MolecularWeight: 474.50998

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2(C(=N)OC1(OC(C2(C#N)C#N)C3=CC(=CC=C3)OCC4=CC=CC=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

CC1C2(C(=N)OC1(OC(C2(C#N)C#N)C3=CC(=CC=C3)OCC4=CC=CC=C4)C5=CC=CC=C5)C#N

InChI

InChI=1S/C29H22N4O3/c1-20-28(19-32)26(33)36-29(20,23-12-6-3-7-13-23)35-25(27(28,17-30)18-31)22-11-8-14-24(15-22)34-16-21-9-4-2-5-10-21/h2-15,20,25,33H,16H2,1H3