N-[4-[4-[bis(azanyl)methylideneamino]butylamino]butyl]-4-nitro-benzamide

Systemtic Name: N-[4-[4-[bis(azanyl)methylideneamino]butylamino]butyl]-4-nitro-benzamide Openeye Name: N-[4-(4-guanidinobutylamino)butyl]-4-nitro-benzamide CAS Name: N-[4-[4-(diaminomethylideneamino)butylamino]butyl]-4-nitrobenzamide IUPAC Name: N-[4-[4-(diaminomethylideneamino)butylamino]butyl]-4-nitrobenzamide Traditional Name: N-[4-(4-guanidinobutylamino)butyl]-4-nitro-benzamide Formula: C16H26N6O3 MolecularWeight: 350.41604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCCCNCCCCN=C(N)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCCCNCCCCN=C(N)N)[N+](=O)[O-]

InChI

InChI=1S/C16H26N6O3/c17-16(18)21-12-4-2-10-19-9-1-3-11-20-15(23)13-5-7-14(8-6-13)22(24)25/h5-8,19H,1-4,9-12H2,(H,20,23)(H4,17,18,21)