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

Systemtic Name: N-[3-[4-(3-azanylpropylamino)butylamino]propyl]-2-benzamido-butanediamide Openeye Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-2-benzamido-butanediamide CAS Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-2-benzamidobutanediamide IUPAC Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-2-benzamidobutanediamide Traditional Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-2-benzamido-succinamide Formula: C21H36N6O3 MolecularWeight: 420.54894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H36N6O3/c22-10-6-13-24-11-4-5-12-25-14-7-15-26-21(30)18(16-19(23)28)27-20(29)17-8-2-1-3-9-17/h1-3,8-9,18,24-25H,4-7,10-16,22H2,(H2,23,28)(H,26,30)(H,27,29)