5-bromanyl-2-methoxy-3-methyl-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]benzamide

Systemtic Name: 5-bromanyl-2-methoxy-3-methyl-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]benzamide Openeye Name: 5-bromo-2-methoxy-3-methyl-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]benzamide CAS Name: 5-bromo-2-methoxy-3-methyl-N-[4-[4-[(E)-1-oxo-3-phenylprop-2-enyl]-1-piperazinyl]phenyl]benzamide IUPAC Name: 5-bromo-2-methoxy-3-methyl-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]benzamide Traditional Name: 5-bromo-2-methoxy-3-methyl-N-[4-[4-[(E)-3-phenylacryloyl]piperazino]phenyl]benzamide Formula: C28H28BrN3O3 MolecularWeight: 534.44422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C=CC4=CC=CC=C4)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)/C=C/C4=CC=CC=C4)OC

InChI

InChI=1S/C28H28BrN3O3/c1-20-18-22(29)19-25(27(20)35-2)28(34)30-23-9-11-24(12-10-23)31-14-16-32(17-15-31)26(33)13-8-21-6-4-3-5-7-21/h3-13,18-19H,14-17H2,1-2H3,(H,30,34)/b13-8+