N-[2-nitro-4-[2-oxidanyl-3-(propylamino)propoxy]phenyl]ethanamide

Systemtic Name: N-[2-nitro-4-[2-oxidanyl-3-(propylamino)propoxy]phenyl]ethanamide Openeye Name: N-[4-[2-hydroxy-3-(propylamino)propoxy]-2-nitro-phenyl]acetamide CAS Name: N-[4-[2-hydroxy-3-(propylamino)propoxy]-2-nitrophenyl]acetamide IUPAC Name: N-[4-[2-hydroxy-3-(propylamino)propoxy]-2-nitrophenyl]acetamide Traditional Name: N-[4-[2-hydroxy-3-(propylamino)propoxy]-2-nitro-phenyl]acetamide Formula: C14H21N3O5 MolecularWeight: 311.33364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNCC(COC1=CC(=C(C=C1)NC(=O)C)[N+](=O)[O-])O

Isomeric SMILES

CCCNCC(COC1=CC(=C(C=C1)NC(=O)C)[N+](=O)[O-])O

InChI

InChI=1S/C14H21N3O5/c1-3-6-15-8-11(19)9-22-12-4-5-13(16-10(2)18)14(7-12)17(20)21/h4-5,7,11,15,19H,3,6,8-9H2,1-2H3,(H,16,18)