3-iodanyl-4-methoxy-N-[4-(3-phenylpropanoylamino)phenyl]benzamide

Systemtic Name: 3-iodanyl-4-methoxy-N-[4-(3-phenylpropanoylamino)phenyl]benzamide Openeye Name: 3-iodo-4-methoxy-N-[4-(3-phenylpropanoylamino)phenyl]benzamide CAS Name: 3-iodo-4-methoxy-N-[4-[(1-oxo-3-phenylpropyl)amino]phenyl]benzamide IUPAC Name: 3-iodo-4-methoxy-N-[4-(3-phenylpropanoylamino)phenyl]benzamide Traditional Name: N-[4-(hydrocinnamoylamino)phenyl]-3-iodo-4-methoxy-benzamide Formula: C23H21IN2O3 MolecularWeight: 500.32891

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=O)CCC3=CC=CC=C3)I

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=O)CCC3=CC=CC=C3)I

InChI

InChI=1S/C23H21IN2O3/c1-29-21-13-8-17(15-20(21)24)23(28)26-19-11-9-18(10-12-19)25-22(27)14-7-16-5-3-2-4-6-16/h2-6,8-13,15H,7,14H2,1H3,(H,25,27)(H,26,28)