(E)-3-(7-bromanyl-1,3-benzodioxol-5-yl)-2-cyano-N-(4-ethylphenyl)prop-2-enamide

Systemtic Name: (E)-3-(7-bromanyl-1,3-benzodioxol-5-yl)-2-cyano-N-(4-ethylphenyl)prop-2-enamide Openeye Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-cyano-N-(4-ethylphenyl)prop-2-enamide CAS Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-cyano-N-(4-ethylphenyl)-2-propenamide IUPAC Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-cyano-N-(4-ethylphenyl)prop-2-enamide Traditional Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-cyano-N-(4-ethylphenyl)acrylamide Formula: C19H15BrN2O3 MolecularWeight: 399.238

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(=CC2=CC3=C(C(=C2)Br)OCO3)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)/C(=C/C2=CC3=C(C(=C2)Br)OCO3)/C#N

InChI

InChI=1S/C19H15BrN2O3/c1-2-12-3-5-15(6-4-12)22-19(23)14(10-21)7-13-8-16(20)18-17(9-13)24-11-25-18/h3-9H,2,11H2,1H3,(H,22,23)/b14-7+