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

Systemtic Name: (E)-3-(7-bromanyl-1,3-benzodioxol-5-yl)-2-cyano-N-(4-fluorophenyl)prop-2-enamide Openeye Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-cyano-N-(4-fluorophenyl)prop-2-enamide CAS Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-cyano-N-(4-fluorophenyl)-2-propenamide IUPAC Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-cyano-N-(4-fluorophenyl)prop-2-enamide Traditional Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-cyano-N-(4-fluorophenyl)acrylamide Formula: C17H10BrFN2O3 MolecularWeight: 389.175303

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)C=C(C#N)C(=O)NC3=CC=C(C=C3)F)Br

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)/C=C(\C#N)/C(=O)NC3=CC=C(C=C3)F)Br

InChI

InChI=1S/C17H10BrFN2O3/c18-14-6-10(7-15-16(14)24-9-23-15)5-11(8-20)17(22)21-13-3-1-12(19)2-4-13/h1-7H,9H2,(H,21,22)/b11-5+