3-[2-[4-(3-nitrophenyl)phenoxy]ethanoylamino]benzoic acid

Systemtic Name: 3-[2-[4-(3-nitrophenyl)phenoxy]ethanoylamino]benzoic acid Openeye Name: 3-[[2-[4-(3-nitrophenyl)phenoxy]acetyl]amino]benzoic acid CAS Name: 3-[[2-[4-(3-nitrophenyl)phenoxy]-1-oxoethyl]amino]benzoic acid IUPAC Name: 3-[[2-[4-(3-nitrophenyl)phenoxy]acetyl]amino]benzoic acid Traditional Name: 3-[[2-[4-(3-nitrophenyl)phenoxy]acetyl]amino]benzoic acid Formula: C21H16N2O6 MolecularWeight: 392.36154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC=C(C=C2)OCC(=O)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC=C(C=C2)OCC(=O)NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C21H16N2O6/c24-20(22-17-5-1-4-16(11-17)21(25)26)13-29-19-9-7-14(8-10-19)15-3-2-6-18(12-15)23(27)28/h1-12H,13H2,(H,22,24)(H,25,26)