2-[6-[2-[(2-bromanyl-4,5-dimethoxy-phenyl)methylideneamino]ethyl]-1,3-benzodioxol-5-yl]ethanenitrile

Systemtic Name: 2-[6-[2-[(2-bromanyl-4,5-dimethoxy-phenyl)methylideneamino]ethyl]-1,3-benzodioxol-5-yl]ethanenitrile Openeye Name: 2-[6-[2-[(2-bromo-4,5-dimethoxy-phenyl)methyleneamino]ethyl]-1,3-benzodioxol-5-yl]acetonitrile CAS Name: 2-[6-[2-[(2-bromo-4,5-dimethoxyphenyl)methylideneamino]ethyl]-1,3-benzodioxol-5-yl]acetonitrile IUPAC Name: 2-[6-[2-[(2-bromo-4,5-dimethoxyphenyl)methylideneamino]ethyl]-1,3-benzodioxol-5-yl]acetonitrile Traditional Name: 2-[6-[2-[(2-bromo-4,5-dimethoxy-benzylidene)amino]ethyl]-1,3-benzodioxol-5-yl]acetonitrile Formula: C20H19BrN2O4 MolecularWeight: 431.27986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=NCCC2=CC3=C(C=C2CC#N)OCO3)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C=NCCC2=CC3=C(C=C2CC#N)OCO3)Br)OC

InChI

InChI=1S/C20H19BrN2O4/c1-24-17-9-15(16(21)10-18(17)25-2)11-23-6-4-14-8-20-19(26-12-27-20)7-13(14)3-5-22/h7-11H,3-4,6,12H2,1-2H3