2-[3-(4-methoxyphenyl)-4-nitro-1-phenyl-butylidene]propanedinitrile

Systemtic Name: 2-[3-(4-methoxyphenyl)-4-nitro-1-phenyl-butylidene]propanedinitrile Openeye Name: 2-[3-(4-methoxyphenyl)-4-nitro-1-phenyl-butylidene]propanedinitrile CAS Name: 2-[3-(4-methoxyphenyl)-4-nitro-1-phenylbutylidene]propanedinitrile IUPAC Name: 2-[3-(4-methoxyphenyl)-4-nitro-1-phenylbutylidene]propanedinitrile Traditional Name: 2-[3-(4-methoxyphenyl)-4-nitro-1-phenyl-butylidene]malononitrile Formula: C20H17N3O3 MolecularWeight: 347.36728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CC(=C(C#N)C#N)C2=CC=CC=C2)C[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C(CC(=C(C#N)C#N)C2=CC=CC=C2)C[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O3/c1-26-19-9-7-15(8-10-19)17(14-23(24)25)11-20(18(12-21)13-22)16-5-3-2-4-6-16/h2-10,17H,11,14H2,1H3