2-[2-(aminomethyl)-4-nitro-phenoxy]-N-butyl-propanamide

Systemtic Name: 2-[2-(aminomethyl)-4-nitro-phenoxy]-N-butyl-propanamide Openeye Name: 2-[2-(aminomethyl)-4-nitro-phenoxy]-N-butyl-propanamide CAS Name: 2-[2-(aminomethyl)-4-nitrophenoxy]-N-butylpropanamide IUPAC Name: 2-[2-(aminomethyl)-4-nitrophenoxy]-N-butylpropanamide Traditional Name: 2-[2-(aminomethyl)-4-nitro-phenoxy]-N-butyl-propionamide Formula: C14H21N3O4 MolecularWeight: 295.33424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C)OC1=C(C=C(C=C1)[N+](=O)[O-])CN

Isomeric SMILES

CCCCNC(=O)C(C)OC1=C(C=C(C=C1)[N+](=O)[O-])CN

InChI

InChI=1S/C14H21N3O4/c1-3-4-7-16-14(18)10(2)21-13-6-5-12(17(19)20)8-11(13)9-15/h5-6,8,10H,3-4,7,9,15H2,1-2H3,(H,16,18)