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

Systemtic Name: (E)-3-(7-bromanyl-1,3-benzodioxol-5-yl)-2-cyano-N-(phenylmethyl)prop-2-enamide Openeye Name: (E)-N-benzyl-3-(7-bromo-1,3-benzodioxol-5-yl)-2-cyano-prop-2-enamide CAS Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-cyano-N-(phenylmethyl)-2-propenamide IUPAC Name: (E)-N-benzyl-3-(7-bromo-1,3-benzodioxol-5-yl)-2-cyanoprop-2-enamide Traditional Name: (E)-N-benzyl-3-(7-bromo-1,3-benzodioxol-5-yl)-2-cyano-acrylamide Formula: C18H13BrN2O3 MolecularWeight: 385.21142

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)C=C(C#N)C(=O)NCC3=CC=CC=C3)Br

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)/C=C(\C#N)/C(=O)NCC3=CC=CC=C3)Br

InChI

InChI=1S/C18H13BrN2O3/c19-15-7-13(8-16-17(15)24-11-23-16)6-14(9-20)18(22)21-10-12-4-2-1-3-5-12/h1-8H,10-11H2,(H,21,22)/b14-6+