N-[3-[4-(3-azanylpropylamino)butylamino]propyl]-2-benzamido-pentanediamide

Systemtic Name: N-[3-[4-(3-azanylpropylamino)butylamino]propyl]-2-benzamido-pentanediamide Openeye Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-2-benzamido-pentanediamide CAS Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-2-benzamidopentanediamide IUPAC Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-2-benzamidopentanediamide Traditional Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-2-benzamido-glutaramide Formula: C22H38N6O3 MolecularWeight: 434.57552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(CCC(=O)N)C(=O)NCCCNCCCCNCCCN

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(CCC(=O)N)C(=O)NCCCNCCCCNCCCN

InChI

InChI=1S/C22H38N6O3/c23-12-6-15-25-13-4-5-14-26-16-7-17-27-22(31)19(10-11-20(24)29)28-21(30)18-8-2-1-3-9-18/h1-3,8-9,19,25-26H,4-7,10-17,23H2,(H2,24,29)(H,27,31)(H,28,30)