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

Systemtic Name: 2-chloranyl-N-[3-chloranyl-4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-5-iodanyl-benzamide Openeye Name: 2-chloro-N-[3-chloro-4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-5-iodo-benzamide CAS Name: 2-chloro-N-[3-chloro-4-[4-[(E)-1-oxo-3-phenylprop-2-enyl]-1-piperazinyl]phenyl]-5-iodobenzamide IUPAC Name: 2-chloro-N-[3-chloro-4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-5-iodobenzamide Traditional Name: 2-chloro-N-[3-chloro-4-[4-[(E)-3-phenylacryloyl]piperazino]phenyl]-5-iodo-benzamide Formula: C26H22Cl2IN3O2 MolecularWeight: 606.28225

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H22Cl2IN3O2/c27-22-9-7-19(29)16-21(22)26(34)30-20-8-10-24(23(28)17-20)31-12-14-32(15-13-31)25(33)11-6-18-4-2-1-3-5-18/h1-11,16-17H,12-15H2,(H,30,34)/b11-6+