(2-methoxy-5-nitro-phenyl)methyl-(2-methyl-1-oxidanyl-propan-2-yl)azanium

Systemtic Name: (2-methoxy-5-nitro-phenyl)methyl-(2-methyl-1-oxidanyl-propan-2-yl)azanium Openeye Name: (2-hydroxy-1,1-dimethyl-ethyl)-[(2-methoxy-5-nitro-phenyl)methyl]ammonium CAS Name: (1-hydroxy-2-methylpropan-2-yl)-[(2-methoxy-5-nitrophenyl)methyl]ammonium IUPAC Name: (1-hydroxy-2-methylpropan-2-yl)-[(2-methoxy-5-nitrophenyl)methyl]azanium Traditional Name: (2-hydroxy-1,1-dimethyl-ethyl)-(2-methoxy-5-nitro-benzyl)ammonium Formula: C12H19N2O4+ MolecularWeight: 255.29026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)[NH2+]CC1=C(C=CC(=C1)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)(CO)[NH2+]CC1=C(C=CC(=C1)[N+](=O)[O-])OC

InChI

InChI=1S/C12H18N2O4/c1-12(2,8-15)13-7-9-6-10(14(16)17)4-5-11(9)18-3/h4-6,13,15H,7-8H2,1-3H3/p+1