2-[5-[(3-aminophenyl)methylamino]-4-azanyl-pentyl]-1-nitro-guanidine

Systemtic Name: 2-[5-[(3-aminophenyl)methylamino]-4-azanyl-pentyl]-1-nitro-guanidine Openeye Name: 2-[4-amino-5-[(3-aminophenyl)methylamino]pentyl]-1-nitro-guanidine CAS Name: 2-[4-amino-5-[(3-aminophenyl)methylamino]pentyl]-1-nitroguanidine IUPAC Name: 2-[4-amino-5-[(3-aminophenyl)methylamino]pentyl]-1-nitroguanidine Traditional Name: 2-[4-amino-5-[(3-aminobenzyl)amino]pentyl]-1-nitro-guanidine Formula: C13H23N7O2 MolecularWeight: 309.36742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N)CNCC(CCCN=C(N)N[N+](=O)[O-])N

Isomeric SMILES

C1=CC(=CC(=C1)N)CNCC(CCCN=C(N)N[N+](=O)[O-])N

InChI

InChI=1S/C13H23N7O2/c14-11-4-1-3-10(7-11)8-17-9-12(15)5-2-6-18-13(16)19-20(21)22/h1,3-4,7,12,17H,2,5-6,8-9,14-15H2,(H3,16,18,19)