4-[3-[3-(3-bromanyl-4-methoxy-phenyl)propanoyl-ethyl-amino]propanoylamino]benzamide

Systemtic Name: 4-[3-[3-(3-bromanyl-4-methoxy-phenyl)propanoyl-ethyl-amino]propanoylamino]benzamide Openeye Name: 4-[3-[3-(3-bromo-4-methoxy-phenyl)propanoyl-ethyl-amino]propanoylamino]benzamide CAS Name: 4-[[3-[[3-(3-bromo-4-methoxyphenyl)-1-oxopropyl]-ethylamino]-1-oxopropyl]amino]benzamide IUPAC Name: 4-[3-[3-(3-bromo-4-methoxyphenyl)propanoyl-ethylamino]propanoylamino]benzamide Traditional Name: 4-[3-[3-(3-bromo-4-methoxy-phenyl)propanoyl-ethyl-amino]propanoylamino]benzamide Formula: C22H26BrN3O4 MolecularWeight: 476.36354

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC(=O)NC1=CC=C(C=C1)C(=O)N)C(=O)CCC2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CCN(CCC(=O)NC1=CC=C(C=C1)C(=O)N)C(=O)CCC2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C22H26BrN3O4/c1-3-26(21(28)11-5-15-4-10-19(30-2)18(23)14-15)13-12-20(27)25-17-8-6-16(7-9-17)22(24)29/h4,6-10,14H,3,5,11-13H2,1-2H3,(H2,24,29)(H,25,27)