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

Systemtic Name: (E)-3-(5-bromanyl-2-methoxy-phenyl)-N-[4-(4-butanoylpiperazin-1-yl)phenyl]prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-methoxy-phenyl)-N-[4-(4-butanoylpiperazin-1-yl)phenyl]prop-2-enamide CAS Name: (E)-3-(5-bromo-2-methoxyphenyl)-N-[4-[4-(1-oxobutyl)-1-piperazinyl]phenyl]-2-propenamide IUPAC Name: (E)-3-(5-bromo-2-methoxyphenyl)-N-[4-(4-butanoylpiperazin-1-yl)phenyl]prop-2-enamide Traditional Name: (E)-3-(5-bromo-2-methoxy-phenyl)-N-[4-(4-butyrylpiperazino)phenyl]acrylamide Formula: C24H28BrN3O3 MolecularWeight: 486.40142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H28BrN3O3/c1-3-4-24(30)28-15-13-27(14-16-28)21-9-7-20(8-10-21)26-23(29)12-5-18-17-19(25)6-11-22(18)31-2/h5-12,17H,3-4,13-16H2,1-2H3,(H,26,29)/b12-5+