2-acetyloxy-3-(4-methoxy-3-nitro-phenyl)propanoic acid

Systemtic Name: 2-acetyloxy-3-(4-methoxy-3-nitro-phenyl)propanoic acid Openeye Name: 2-acetoxy-3-(4-methoxy-3-nitro-phenyl)propanoic acid CAS Name: 2-acetyloxy-3-(4-methoxy-3-nitrophenyl)propanoic acid IUPAC Name: 2-acetyloxy-3-(4-methoxy-3-nitrophenyl)propanoic acid Traditional Name: 2-acetoxy-3-(4-methoxy-3-nitro-phenyl)propionic acid Formula: C12H13NO7 MolecularWeight: 283.23412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO7/c1-7(14)20-11(12(15)16)6-8-3-4-10(19-2)9(5-8)13(17)18/h3-5,11H,6H2,1-2H3,(H,15,16)