2-[4-(hydroxymethyl)-2-methoxy-5-nitro-phenoxy]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-(hydroxymethyl)-2-methoxy-5-nitro-phenoxy]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-(hydroxymethyl)-2-methoxy-5-nitro-phenoxy]acetamide CAS Name: 2-[4-(hydroxymethyl)-2-methoxy-5-nitrophenoxy]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(hydroxymethyl)-2-methoxy-5-nitrophenoxy]acetamide Traditional Name: N-benzyl-2-(2-methoxy-4-methylol-5-nitro-phenoxy)acetamide Formula: C17H18N2O6 MolecularWeight: 346.33462

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CO)[N+](=O)[O-])OCC(=O)NCC2=CC=CC=C2

Isomeric SMILES

COC1=C(C=C(C(=C1)CO)[N+](=O)[O-])OCC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C17H18N2O6/c1-24-15-7-13(10-20)14(19(22)23)8-16(15)25-11-17(21)18-9-12-5-3-2-4-6-12/h2-8,20H,9-11H2,1H3,(H,18,21)