2-[3-[[[azanyl-(cyclopropylamino)methylidene]amino]methyl]phenyl]-1-nitro-guanidine

Systemtic Name: 2-[3-[[[azanyl-(cyclopropylamino)methylidene]amino]methyl]phenyl]-1-nitro-guanidine Openeye Name: 2-[3-[[[amino-(cyclopropylamino)methylene]amino]methyl]phenyl]-1-nitro-guanidine CAS Name: 2-[3-[[[amino-(cyclopropylamino)methylidene]amino]methyl]phenyl]-1-nitroguanidine IUPAC Name: 2-[3-[[[amino-(cyclopropylamino)methylidene]amino]methyl]phenyl]-1-nitroguanidine Traditional Name: 2-[3-[[[amino-(cyclopropylamino)methylene]amino]methyl]phenyl]-1-nitro-guanidine Formula: C12H17N7O2 MolecularWeight: 291.30908

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=NCC2=CC(=CC=C2)N=C(N)N[N+](=O)[O-])N

Isomeric SMILES

C1CC1NC(=NCC2=CC(=CC=C2)N=C(N)N[N+](=O)[O-])N

InChI

InChI=1S/C12H17N7O2/c13-11(16-9-4-5-9)15-7-8-2-1-3-10(6-8)17-12(14)18-19(20)21/h1-3,6,9H,4-5,7H2,(H3,13,15,16)(H3,14,17,18)