3-bromanyl-4-hexoxy-N-[4-(3-phenylpropanoylamino)phenyl]benzamide

Systemtic Name: 3-bromanyl-4-hexoxy-N-[4-(3-phenylpropanoylamino)phenyl]benzamide Openeye Name: 3-bromo-4-hexoxy-N-[4-(3-phenylpropanoylamino)phenyl]benzamide CAS Name: 3-bromo-4-hexoxy-N-[4-[(1-oxo-3-phenylpropyl)amino]phenyl]benzamide IUPAC Name: 3-bromo-4-hexoxy-N-[4-(3-phenylpropanoylamino)phenyl]benzamide Traditional Name: 3-bromo-4-hexoxy-N-[4-(hydrocinnamoylamino)phenyl]benzamide Formula: C28H31BrN2O3 MolecularWeight: 523.46134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=O)CCC3=CC=CC=C3)Br

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=O)CCC3=CC=CC=C3)Br

InChI

InChI=1S/C28H31BrN2O3/c1-2-3-4-8-19-34-26-17-12-22(20-25(26)29)28(33)31-24-15-13-23(14-16-24)30-27(32)18-11-21-9-6-5-7-10-21/h5-7,9-10,12-17,20H,2-4,8,11,18-19H2,1H3,(H,30,32)(H,31,33)