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

Systemtic Name: 5-bromanyl-N-[3-chloranyl-4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-2-methoxy-benzamide Openeye Name: 5-bromo-N-[3-chloro-4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-2-methoxy-benzamide CAS Name: 5-bromo-N-[3-chloro-4-[4-[(E)-1-oxo-3-phenylprop-2-enyl]-1-piperazinyl]phenyl]-2-methoxybenzamide IUPAC Name: 5-bromo-N-[3-chloro-4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-2-methoxybenzamide Traditional Name: 5-bromo-N-[3-chloro-4-[4-[(E)-3-phenylacryloyl]piperazino]phenyl]-2-methoxy-benzamide Formula: C27H25BrClN3O3 MolecularWeight: 554.8627

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C=CC4=CC=CC=C4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)/C=C/C4=CC=CC=C4)Cl

InChI

InChI=1S/C27H25BrClN3O3/c1-35-25-11-8-20(28)17-22(25)27(34)30-21-9-10-24(23(29)18-21)31-13-15-32(16-14-31)26(33)12-7-19-5-3-2-4-6-19/h2-12,17-18H,13-16H2,1H3,(H,30,34)/b12-7+