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

Systemtic Name: N-[5-chloranyl-2-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-N-[5-chloro-2-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]benzamide CAS Name: N-[5-chloro-2-[4-[(E)-1-oxo-3-phenylprop-2-enyl]-1-piperazinyl]phenyl]-3-phenylmethoxybenzamide IUPAC Name: N-[5-chloro-2-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-3-phenylmethoxybenzamide Traditional Name: 3-benzoxy-N-[5-chloro-2-[4-[(E)-3-phenylacryloyl]piperazino]phenyl]benzamide Formula: C33H30ClN3O3 MolecularWeight: 552.0626

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)Cl)NC(=O)C3=CC(=CC=C3)OCC4=CC=CC=C4)C(=O)C=CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)Cl)NC(=O)C3=CC(=CC=C3)OCC4=CC=CC=C4)C(=O)/C=C/C5=CC=CC=C5

InChI

InChI=1S/C33H30ClN3O3/c34-28-15-16-31(36-18-20-37(21-19-36)32(38)17-14-25-8-3-1-4-9-25)30(23-28)35-33(39)27-12-7-13-29(22-27)40-24-26-10-5-2-6-11-26/h1-17,22-23H,18-21,24H2,(H,35,39)/b17-14+