6-methoxy-2,4-dimethyl-3-(3-nitro-2-oxidanyl-propyl)phenol

Systemtic Name: 6-methoxy-2,4-dimethyl-3-(3-nitro-2-oxidanyl-propyl)phenol Openeye Name: 3-(2-hydroxy-3-nitro-propyl)-6-methoxy-2,4-dimethyl-phenol CAS Name: 3-(2-hydroxy-3-nitropropyl)-6-methoxy-2,4-dimethylphenol IUPAC Name: 3-(2-hydroxy-3-nitropropyl)-6-methoxy-2,4-dimethylphenol Traditional Name: 3-(2-hydroxy-3-nitro-propyl)-6-methoxy-2,4-dimethyl-phenol Formula: C12H17NO5 MolecularWeight: 255.26708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1CC(C[N+](=O)[O-])O)C)O)OC

Isomeric SMILES

CC1=CC(=C(C(=C1CC(C[N+](=O)[O-])O)C)O)OC

InChI

InChI=1S/C12H17NO5/c1-7-4-11(18-3)12(15)8(2)10(7)5-9(14)6-13(16)17/h4,9,14-15H,5-6H2,1-3H3