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

Systemtic Name: (E)-3-(7-bromanyl-1,3-benzodioxol-5-yl)-2-cyano-N-cyclohexyl-prop-2-enamide Openeye Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-cyano-N-cyclohexyl-prop-2-enamide CAS Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-cyano-N-cyclohexyl-2-propenamide IUPAC Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-cyano-N-cyclohexylprop-2-enamide Traditional Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-cyano-N-cyclohexyl-acrylamide Formula: C17H17BrN2O3 MolecularWeight: 377.23248

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(=CC2=CC3=C(C(=C2)Br)OCO3)C#N

Isomeric SMILES

C1CCC(CC1)NC(=O)/C(=C/C2=CC3=C(C(=C2)Br)OCO3)/C#N

InChI

InChI=1S/C17H17BrN2O3/c18-14-7-11(8-15-16(14)23-10-22-15)6-12(9-19)17(21)20-13-4-2-1-3-5-13/h6-8,13H,1-5,10H2,(H,20,21)/b12-6+