2-[4-(hydroxymethyl)-2-nitro-phenoxy]-N-propyl-propanamide

Systemtic Name: 2-[4-(hydroxymethyl)-2-nitro-phenoxy]-N-propyl-propanamide Openeye Name: 2-[4-(hydroxymethyl)-2-nitro-phenoxy]-N-propyl-propanamide CAS Name: 2-[4-(hydroxymethyl)-2-nitrophenoxy]-N-propylpropanamide IUPAC Name: 2-[4-(hydroxymethyl)-2-nitrophenoxy]-N-propylpropanamide Traditional Name: 2-(4-methylol-2-nitro-phenoxy)-N-propyl-propionamide Formula: C13H18N2O5 MolecularWeight: 282.29242

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC1=C(C=C(C=C1)CO)[N+](=O)[O-]

Isomeric SMILES

CCCNC(=O)C(C)OC1=C(C=C(C=C1)CO)[N+](=O)[O-]

InChI

InChI=1S/C13H18N2O5/c1-3-6-14-13(17)9(2)20-12-5-4-10(8-16)7-11(12)15(18)19/h4-5,7,9,16H,3,6,8H2,1-2H3,(H,14,17)