(E)-3-(2-bromanyl-4,5-dimethoxy-phenyl)-2-(1,2-oxazol-5-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(2-bromanyl-4,5-dimethoxy-phenyl)-2-(1,2-oxazol-5-yl)prop-2-enenitrile Openeye Name: (E)-3-(2-bromo-4,5-dimethoxy-phenyl)-2-isoxazol-5-yl-prop-2-enenitrile CAS Name: (E)-3-(2-bromo-4,5-dimethoxyphenyl)-2-(5-isoxazolyl)-2-propenenitrile IUPAC Name: (E)-3-(2-bromo-4,5-dimethoxyphenyl)-2-(1,2-oxazol-5-yl)prop-2-enenitrile Traditional Name: (E)-3-(2-bromo-4,5-dimethoxy-phenyl)-2-isoxazol-5-yl-acrylonitrile Formula: C14H11BrN2O3 MolecularWeight: 335.15274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C(C#N)C2=CC=NO2)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)/C=C(\C#N)/C2=CC=NO2)Br)OC

InChI

InChI=1S/C14H11BrN2O3/c1-18-13-6-9(11(15)7-14(13)19-2)5-10(8-16)12-3-4-17-20-12/h3-7H,1-2H3/b10-5+