1-(4-bromanyl-3-methyl-phenyl)-1-methyl-2-nitro-guanidine

Systemtic Name: 1-(4-bromanyl-3-methyl-phenyl)-1-methyl-2-nitro-guanidine Openeye Name: 1-(4-bromo-3-methyl-phenyl)-1-methyl-2-nitro-guanidine CAS Name: 1-(4-bromo-3-methylphenyl)-1-methyl-2-nitroguanidine IUPAC Name: 1-(4-bromo-3-methylphenyl)-1-methyl-2-nitroguanidine Traditional Name: 1-(4-bromo-3-methyl-phenyl)-1-methyl-2-nitro-guanidine Formula: C9H11BrN4O2 MolecularWeight: 287.11324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N(C)C(=N[N+](=O)[O-])N)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N(C)/C(=N\[N+](=O)[O-])/N)Br

InChI

InChI=1S/C9H11BrN4O2/c1-6-5-7(3-4-8(6)10)13(2)9(11)12-14(15)16/h3-5H,1-2H3,(H2,11,12)