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

Systemtic Name: 6-azanylidene-3-heptan-3-yl-8-(4-methoxyphenyl)-1-methyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Openeye Name: 3-(1-ethylpentyl)-6-imino-8-(4-methoxyphenyl)-1-methyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile CAS Name: 3-heptan-3-yl-6-imino-8-(4-methoxyphenyl)-1-methyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile IUPAC Name: 3-heptan-3-yl-6-imino-8-(4-methoxyphenyl)-1-methyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Traditional Name: 3-(1-ethylpentyl)-6-imino-8-(4-methoxyphenyl)-1-methyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Formula: C24H28N4O3 MolecularWeight: 420.50412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C1C(C2(C(C(O1)(OC2=N)C)C3=CC=C(C=C3)OC)C#N)(C#N)C#N

Isomeric SMILES

CCCCC(CC)C1C(C2(C(C(O1)(OC2=N)C)C3=CC=C(C=C3)OC)C#N)(C#N)C#N

InChI

InChI=1S/C24H28N4O3/c1-5-7-8-16(6-2)20-23(13-25,14-26)24(15-27)19(22(3,30-20)31-21(24)28)17-9-11-18(29-4)12-10-17/h9-12,16,19-20,28H,5-8H2,1-4H3