3-(2-nitro-4-phenylmethoxy-phenyl)-2-oxidanyl-propanoic acid

Systemtic Name: 3-(2-nitro-4-phenylmethoxy-phenyl)-2-oxidanyl-propanoic acid Openeye Name: 3-(4-benzyloxy-2-nitro-phenyl)-2-hydroxy-propanoic acid CAS Name: 2-hydroxy-3-(2-nitro-4-phenylmethoxyphenyl)propanoic acid IUPAC Name: 2-hydroxy-3-(2-nitro-4-phenylmethoxyphenyl)propanoic acid Traditional Name: 3-(4-benzoxy-2-nitro-phenyl)-2-hydroxy-propionic acid Formula: C16H15NO6 MolecularWeight: 317.2934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC(=C(C=C2)CC(C(=O)O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC(=C(C=C2)CC(C(=O)O)O)[N+](=O)[O-]

InChI

InChI=1S/C16H15NO6/c18-15(16(19)20)8-12-6-7-13(9-14(12)17(21)22)23-10-11-4-2-1-3-5-11/h1-7,9,15,18H,8,10H2,(H,19,20)