5-bromanyl-2-methoxy-N-[4-(3-phenylpropanoylamino)phenyl]benzamide

Systemtic Name: 5-bromanyl-2-methoxy-N-[4-(3-phenylpropanoylamino)phenyl]benzamide Openeye Name: 5-bromo-2-methoxy-N-[4-(3-phenylpropanoylamino)phenyl]benzamide CAS Name: 5-bromo-2-methoxy-N-[4-[(1-oxo-3-phenylpropyl)amino]phenyl]benzamide IUPAC Name: 5-bromo-2-methoxy-N-[4-(3-phenylpropanoylamino)phenyl]benzamide Traditional Name: 5-bromo-N-[4-(hydrocinnamoylamino)phenyl]-2-methoxy-benzamide Formula: C23H21BrN2O3 MolecularWeight: 453.32844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21BrN2O3/c1-29-21-13-8-17(24)15-20(21)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)