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

Systemtic Name: 2-[2-(hydroxymethyl)-4-nitro-phenoxy]-N-propyl-propanamide Openeye Name: 2-[2-(hydroxymethyl)-4-nitro-phenoxy]-N-propyl-propanamide CAS Name: 2-[2-(hydroxymethyl)-4-nitrophenoxy]-N-propylpropanamide IUPAC Name: 2-[2-(hydroxymethyl)-4-nitrophenoxy]-N-propylpropanamide Traditional Name: 2-(2-methylol-4-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)[N+](=O)[O-])CO

Isomeric SMILES

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

InChI

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