3-(2-nitrophenyl)-2-oxidanylidene-3-phenylmethoxy-propanoic acid

Systemtic Name: 3-(2-nitrophenyl)-2-oxidanylidene-3-phenylmethoxy-propanoic acid Openeye Name: 3-benzyloxy-3-(2-nitrophenyl)-2-oxo-propanoic acid CAS Name: 3-(2-nitrophenyl)-2-oxo-3-phenylmethoxypropanoic acid IUPAC Name: 3-(2-nitrophenyl)-2-oxo-3-phenylmethoxypropanoic acid Traditional Name: 3-benzoxy-2-keto-3-(2-nitrophenyl)propionic acid Formula: C16H13NO6 MolecularWeight: 315.27752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13NO6/c18-14(16(19)20)15(23-10-11-6-2-1-3-7-11)12-8-4-5-9-13(12)17(21)22/h1-9,15H,10H2,(H,19,20)