phenyl 4-[2-(2-nitrophenoxy)ethanoylamino]-2-oxidanyl-benzoate

Systemtic Name: phenyl 4-[2-(2-nitrophenoxy)ethanoylamino]-2-oxidanyl-benzoate Openeye Name: phenyl 2-hydroxy-4-[[2-(2-nitrophenoxy)acetyl]amino]benzoate CAS Name: 2-hydroxy-4-[[2-(2-nitrophenoxy)-1-oxoethyl]amino]benzoic acid phenyl ester IUPAC Name: phenyl 2-hydroxy-4-[[2-(2-nitrophenoxy)acetyl]amino]benzoate Traditional Name: 2-hydroxy-4-[[2-(2-nitrophenoxy)acetyl]amino]benzoic acid phenyl ester Formula: C21H16N2O7 MolecularWeight: 408.36094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)C2=C(C=C(C=C2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)C2=C(C=C(C=C2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-])O

InChI

InChI=1S/C21H16N2O7/c24-18-12-14(10-11-16(18)21(26)30-15-6-2-1-3-7-15)22-20(25)13-29-19-9-5-4-8-17(19)23(27)28/h1-12,24H,13H2,(H,22,25)