(E)-3-[3,5-bis(bromanyl)-2-methoxy-phenyl]-N-(4-piperidin-1-ylphenyl)prop-2-enamide

Systemtic Name: (E)-3-[3,5-bis(bromanyl)-2-methoxy-phenyl]-N-(4-piperidin-1-ylphenyl)prop-2-enamide Openeye Name: (E)-3-(3,5-dibromo-2-methoxy-phenyl)-N-[4-(1-piperidyl)phenyl]prop-2-enamide CAS Name: (E)-3-(3,5-dibromo-2-methoxyphenyl)-N-[4-(1-piperidinyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(3,5-dibromo-2-methoxyphenyl)-N-(4-piperidin-1-ylphenyl)prop-2-enamide Traditional Name: (E)-3-(3,5-dibromo-2-methoxy-phenyl)-N-(4-piperidinophenyl)acrylamide Formula: C21H22Br2N2O2 MolecularWeight: 494.21958

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C=CC(=O)NC2=CC=C(C=C2)N3CCCCC3)Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1/C=C/C(=O)NC2=CC=C(C=C2)N3CCCCC3)Br)Br

InChI

InChI=1S/C21H22Br2N2O2/c1-27-21-15(13-16(22)14-19(21)23)5-10-20(26)24-17-6-8-18(9-7-17)25-11-3-2-4-12-25/h5-10,13-14H,2-4,11-12H2,1H3,(H,24,26)/b10-5+