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

Systemtic Name: N-cyclopropyl-2-[4-(hydroxymethyl)-2-methoxy-5-nitro-phenoxy]ethanamide Openeye Name: N-cyclopropyl-2-[4-(hydroxymethyl)-2-methoxy-5-nitro-phenoxy]acetamide CAS Name: N-cyclopropyl-2-[4-(hydroxymethyl)-2-methoxy-5-nitrophenoxy]acetamide IUPAC Name: N-cyclopropyl-2-[4-(hydroxymethyl)-2-methoxy-5-nitrophenoxy]acetamide Traditional Name: N-cyclopropyl-2-(2-methoxy-4-methylol-5-nitro-phenoxy)acetamide Formula: C13H16N2O6 MolecularWeight: 296.27594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CO)[N+](=O)[O-])OCC(=O)NC2CC2

Isomeric SMILES

COC1=C(C=C(C(=C1)CO)[N+](=O)[O-])OCC(=O)NC2CC2

InChI

InChI=1S/C13H16N2O6/c1-20-11-4-8(6-16)10(15(18)19)5-12(11)21-7-13(17)14-9-2-3-9/h4-5,9,16H,2-3,6-7H2,1H3,(H,14,17)