(E)-N-(2-adamantyl)-3-[3,5-bis(bromanyl)-2-methoxy-phenyl]prop-2-enamide

Systemtic Name: (E)-N-(2-adamantyl)-3-[3,5-bis(bromanyl)-2-methoxy-phenyl]prop-2-enamide Openeye Name: (E)-N-(2-adamantyl)-3-(3,5-dibromo-2-methoxy-phenyl)prop-2-enamide CAS Name: (E)-N-(2-adamantyl)-3-(3,5-dibromo-2-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(2-adamantyl)-3-(3,5-dibromo-2-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-(2-adamantyl)-3-(3,5-dibromo-2-methoxy-phenyl)acrylamide Formula: C20H23Br2NO2 MolecularWeight: 469.21012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C=CC(=O)NC2C3CC4CC(C3)CC2C4)Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1/C=C/C(=O)NC2C3CC4CC(C3)CC2C4)Br)Br

InChI

InChI=1S/C20H23Br2NO2/c1-25-20-13(9-16(21)10-17(20)22)2-3-18(24)23-19-14-5-11-4-12(7-14)8-15(19)6-11/h2-3,9-12,14-15,19H,4-8H2,1H3,(H,23,24)/b3-2+