1-(4-methyl-3-nitro-phenyl)-2-nitro-ethanol

Systemtic Name: 1-(4-methyl-3-nitro-phenyl)-2-nitro-ethanol Openeye Name: 1-(4-methyl-3-nitro-phenyl)-2-nitro-ethanol CAS Name: 1-(4-methyl-3-nitrophenyl)-2-nitroethanol IUPAC Name: 1-(4-methyl-3-nitrophenyl)-2-nitroethanol Traditional Name: 1-(4-methyl-3-nitro-phenyl)-2-nitro-ethanol Formula: C9H10N2O5 MolecularWeight: 226.1861

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10N2O5/c1-6-2-3-7(4-8(6)11(15)16)9(12)5-10(13)14/h2-4,9,12H,5H2,1H3