4-[3-(2-bromanyl-4,5-dimethoxy-phenyl)propanoylamino]benzamide

Systemtic Name: 4-[3-(2-bromanyl-4,5-dimethoxy-phenyl)propanoylamino]benzamide Openeye Name: 4-[3-(2-bromo-4,5-dimethoxy-phenyl)propanoylamino]benzamide CAS Name: 4-[[3-(2-bromo-4,5-dimethoxyphenyl)-1-oxopropyl]amino]benzamide IUPAC Name: 4-[3-(2-bromo-4,5-dimethoxyphenyl)propanoylamino]benzamide Traditional Name: 4-[3-(2-bromo-4,5-dimethoxy-phenyl)propanoylamino]benzamide Formula: C18H19BrN2O4 MolecularWeight: 407.25846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19BrN2O4/c1-24-15-9-12(14(19)10-16(15)25-2)5-8-17(22)21-13-6-3-11(4-7-13)18(20)23/h3-4,6-7,9-10H,5,8H2,1-2H3,(H2,20,23)(H,21,22)