5-[3-(3-bromanyl-4-methoxy-phenyl)propanoylamino]benzene-1,3-dicarboxamide

Systemtic Name: 5-[3-(3-bromanyl-4-methoxy-phenyl)propanoylamino]benzene-1,3-dicarboxamide Openeye Name: 5-[3-(3-bromo-4-methoxy-phenyl)propanoylamino]benzene-1,3-dicarboxamide CAS Name: 5-[[3-(3-bromo-4-methoxyphenyl)-1-oxopropyl]amino]benzene-1,3-dicarboxamide IUPAC Name: 5-[3-(3-bromo-4-methoxyphenyl)propanoylamino]benzene-1,3-dicarboxamide Traditional Name: 5-[3-(3-bromo-4-methoxy-phenyl)propanoylamino]isophthalamide Formula: C18H18BrN3O4 MolecularWeight: 420.25722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)NC2=CC(=CC(=C2)C(=O)N)C(=O)N)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)NC2=CC(=CC(=C2)C(=O)N)C(=O)N)Br

InChI

InChI=1S/C18H18BrN3O4/c1-26-15-4-2-10(6-14(15)19)3-5-16(23)22-13-8-11(17(20)24)7-12(9-13)18(21)25/h2,4,6-9H,3,5H2,1H3,(H2,20,24)(H2,21,25)(H,22,23)