N-[3-[4-(3-azanylpropylamino)butylamino]propyl]-5-azido-2-nitro-benzamide

Systemtic Name: N-[3-[4-(3-azanylpropylamino)butylamino]propyl]-5-azido-2-nitro-benzamide Openeye Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-5-azido-2-nitro-benzamide CAS Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-5-azido-2-nitrobenzamide IUPAC Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-5-azido-2-nitrobenzamide Traditional Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-5-azido-2-nitro-benzamide Formula: C17H28N8O3 MolecularWeight: 392.45602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N=[N+]=[N-])C(=O)NCCCNCCCCNCCCN)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1N=[N+]=[N-])C(=O)NCCCNCCCCNCCCN)[N+](=O)[O-]

InChI

InChI=1S/C17H28N8O3/c18-7-3-10-20-8-1-2-9-21-11-4-12-22-17(26)15-13-14(23-24-19)5-6-16(15)25(27)28/h5-6,13,20-21H,1-4,7-12,18H2,(H,22,26)