N-[3-[4-(3-azanylpropylamino)butylamino]propyl]-3,4-dimethoxy-5-phenylmethoxy-benzamide

Systemtic Name: N-[3-[4-(3-azanylpropylamino)butylamino]propyl]-3,4-dimethoxy-5-phenylmethoxy-benzamide Openeye Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-3-benzyloxy-4,5-dimethoxy-benzamide CAS Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-3,4-dimethoxy-5-phenylmethoxybenzamide IUPAC Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-3,4-dimethoxy-5-phenylmethoxybenzamide Traditional Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-3-benzoxy-4,5-dimethoxy-benzamide Formula: C26H40N4O4 MolecularWeight: 472.6202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)NCCCNCCCCNCCCN)OCC2=CC=CC=C2)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)NCCCNCCCCNCCCN)OCC2=CC=CC=C2)OC

InChI

InChI=1S/C26H40N4O4/c1-32-23-18-22(19-24(25(23)33-2)34-20-21-10-4-3-5-11-21)26(31)30-17-9-16-29-14-7-6-13-28-15-8-12-27/h3-5,10-11,18-19,28-29H,6-9,12-17,20,27H2,1-2H3,(H,30,31)