dimethyl-[(4-nitro-2-oxidanyl-phenyl)methyl]azanium

Systemtic Name: dimethyl-[(4-nitro-2-oxidanyl-phenyl)methyl]azanium Openeye Name: (2-hydroxy-4-nitro-phenyl)methyl-dimethyl-ammonium CAS Name: (2-hydroxy-4-nitrophenyl)methyl-dimethylammonium IUPAC Name: (2-hydroxy-4-nitrophenyl)methyl-dimethylazanium Traditional Name: (2-hydroxy-4-nitro-benzyl)-dimethyl-ammonium Formula: C9H13N2O3+ MolecularWeight: 197.21112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12N2O3/c1-10(2)6-7-3-4-8(11(13)14)5-9(7)12/h3-5,12H,6H2,1-2H3/p+1