2-acetyloxy-3-(4-nitrophenyl)propanoic acid

Systemtic Name: 2-acetyloxy-3-(4-nitrophenyl)propanoic acid Openeye Name: 2-acetoxy-3-(4-nitrophenyl)propanoic acid CAS Name: 2-acetyloxy-3-(4-nitrophenyl)propanoic acid IUPAC Name: 2-acetyloxy-3-(4-nitrophenyl)propanoic acid Traditional Name: 2-acetoxy-3-(4-nitrophenyl)propionic acid Formula: C11H11NO6 MolecularWeight: 253.20814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(=O)OC(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C11H11NO6/c1-7(13)18-10(11(14)15)6-8-2-4-9(5-3-8)12(16)17/h2-5,10H,6H2,1H3,(H,14,15)