3-[4-(hydroxymethyl)-2-methoxy-5-nitro-phenoxy]propanamide

Systemtic Name: 3-[4-(hydroxymethyl)-2-methoxy-5-nitro-phenoxy]propanamide Openeye Name: 3-[4-(hydroxymethyl)-2-methoxy-5-nitro-phenoxy]propanamide CAS Name: 3-[4-(hydroxymethyl)-2-methoxy-5-nitrophenoxy]propanamide IUPAC Name: 3-[4-(hydroxymethyl)-2-methoxy-5-nitrophenoxy]propanamide Traditional Name: 3-(2-methoxy-4-methylol-5-nitro-phenoxy)propionamide Formula: C11H14N2O6 MolecularWeight: 270.23866

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CO)[N+](=O)[O-])OCCC(=O)N

Isomeric SMILES

COC1=C(C=C(C(=C1)CO)[N+](=O)[O-])OCCC(=O)N

InChI

InChI=1S/C11H14N2O6/c1-18-9-4-7(6-14)8(13(16)17)5-10(9)19-3-2-11(12)15/h4-5,14H,2-3,6H2,1H3,(H2,12,15)