2-[4-(1-azanyl-2-methyl-propan-2-yl)phenyl]-1-nitro-guanidine hydrochloride

Systemtic Name: 2-[4-(1-azanyl-2-methyl-propan-2-yl)phenyl]-1-nitro-guanidine hydrochloride Openeye Name: 2-[4-(2-amino-1,1-dimethyl-ethyl)phenyl]-1-nitro-guanidine hydrochloride CAS Name: 2-[4-(1-amino-2-methylpropan-2-yl)phenyl]-1-nitroguanidine hydrochloride IUPAC Name: 2-[4-(1-amino-2-methylpropan-2-yl)phenyl]-1-nitroguanidine hydrochloride Traditional Name: 2-[4-(2-amino-1,1-dimethyl-ethyl)phenyl]-1-nitro-guanidine hydrochloride Formula: C11H18ClN5O2 MolecularWeight: 287.74592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN)C1=CC=C(C=C1)N=C(N)N[N+](=O)[O-].Cl

Isomeric SMILES

CC(C)(CN)C1=CC=C(C=C1)N=C(N)N[N+](=O)[O-].Cl

InChI

InChI=1S/C11H17N5O2.ClH/c1-11(2,7-12)8-3-5-9(6-4-8)14-10(13)15-16(17)18;/h3-6H,7,12H2,1-2H3,(H3,13,14,15);1H