2-[5-bromanyl-1-[(3,4-dimethoxyphenyl)methyl]-2-oxidanylidene-indol-3-ylidene]propanedinitrile

Systemtic Name: 2-[5-bromanyl-1-[(3,4-dimethoxyphenyl)methyl]-2-oxidanylidene-indol-3-ylidene]propanedinitrile Openeye Name: 2-[5-bromo-1-[(3,4-dimethoxyphenyl)methyl]-2-oxo-indolin-3-ylidene]propanedinitrile CAS Name: 2-[5-bromo-1-[(3,4-dimethoxyphenyl)methyl]-2-oxo-3-indolylidene]propanedinitrile IUPAC Name: 2-[5-bromo-1-[(3,4-dimethoxyphenyl)methyl]-2-oxoindol-3-ylidene]propanedinitrile Traditional Name: 2-(5-bromo-2-keto-1-veratryl-indolin-3-ylidene)malononitrile Formula: C20H14BrN3O3 MolecularWeight: 424.24746

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C3=C(C=C(C=C3)Br)C(=C(C#N)C#N)C2=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C3=C(C=C(C=C3)Br)C(=C(C#N)C#N)C2=O)OC

InChI

InChI=1S/C20H14BrN3O3/c1-26-17-6-3-12(7-18(17)27-2)11-24-16-5-4-14(21)8-15(16)19(20(24)25)13(9-22)10-23/h3-8H,11H2,1-2H3