(E)-3-(5-bromanyl-2-methoxy-phenyl)-N-[3-chloranyl-4-(4-ethanoylpiperazin-1-yl)phenyl]prop-2-enamide

Systemtic Name: (E)-3-(5-bromanyl-2-methoxy-phenyl)-N-[3-chloranyl-4-(4-ethanoylpiperazin-1-yl)phenyl]prop-2-enamide Openeye Name: (E)-N-[4-(4-acetylpiperazin-1-yl)-3-chloro-phenyl]-3-(5-bromo-2-methoxy-phenyl)prop-2-enamide CAS Name: (E)-N-[4-(4-acetyl-1-piperazinyl)-3-chlorophenyl]-3-(5-bromo-2-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-3-(5-bromo-2-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-[4-(4-acetylpiperazino)-3-chloro-phenyl]-3-(5-bromo-2-methoxy-phenyl)acrylamide Formula: C22H23BrClN3O3 MolecularWeight: 492.79332

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C=CC3=C(C=CC(=C3)Br)OC)Cl

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)/C=C/C3=C(C=CC(=C3)Br)OC)Cl

InChI

InChI=1S/C22H23BrClN3O3/c1-15(28)26-9-11-27(12-10-26)20-6-5-18(14-19(20)24)25-22(29)8-3-16-13-17(23)4-7-21(16)30-2/h3-8,13-14H,9-12H2,1-2H3,(H,25,29)/b8-3+