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

Systemtic Name: 3-bromanyl-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]benzamide Openeye Name: 3-bromo-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]benzamide CAS Name: 3-bromo-N-[4-[4-[(E)-1-oxo-3-phenylprop-2-enyl]-1-piperazinyl]phenyl]benzamide IUPAC Name: 3-bromo-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]benzamide Traditional Name: 3-bromo-N-[4-[4-[(E)-3-phenylacryloyl]piperazino]phenyl]benzamide Formula: C26H24BrN3O2 MolecularWeight: 490.39166

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)Br)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)Br)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C26H24BrN3O2/c27-22-8-4-7-21(19-22)26(32)28-23-10-12-24(13-11-23)29-15-17-30(18-16-29)25(31)14-9-20-5-2-1-3-6-20/h1-14,19H,15-18H2,(H,28,32)/b14-9+