N-[3-[4-(3-azanylpropylamino)butylamino]propyl]-2-(2-bromanyl-4,5-dimethoxy-phenyl)ethanamide

Systemtic Name: N-[3-[4-(3-azanylpropylamino)butylamino]propyl]-2-(2-bromanyl-4,5-dimethoxy-phenyl)ethanamide Openeye Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-2-(2-bromo-4,5-dimethoxy-phenyl)acetamide CAS Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-2-(2-bromo-4,5-dimethoxyphenyl)acetamide IUPAC Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-2-(2-bromo-4,5-dimethoxyphenyl)acetamide Traditional Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-2-(2-bromo-4,5-dimethoxy-phenyl)acetamide Formula: C20H35BrN4O3 MolecularWeight: 459.4209

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CC(=O)NCCCNCCCCNCCCN)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CC(=O)NCCCNCCCCNCCCN)Br)OC

InChI

InChI=1S/C20H35BrN4O3/c1-27-18-13-16(17(21)15-19(18)28-2)14-20(26)25-12-6-11-24-9-4-3-8-23-10-5-7-22/h13,15,23-24H,3-12,14,22H2,1-2H3,(H,25,26)