2-[[3-[(3-chlorophenyl)methoxy]-2-nitro-phenyl]methoxy]benzoic acid

Systemtic Name: 2-[[3-[(3-chlorophenyl)methoxy]-2-nitro-phenyl]methoxy]benzoic acid Openeye Name: 2-[[3-[(3-chlorophenyl)methoxy]-2-nitro-phenyl]methoxy]benzoic acid CAS Name: 2-[[3-[(3-chlorophenyl)methoxy]-2-nitrophenyl]methoxy]benzoic acid IUPAC Name: 2-[[3-[(3-chlorophenyl)methoxy]-2-nitrophenyl]methoxy]benzoic acid Traditional Name: 2-[3-(3-chlorobenzyl)oxy-2-nitro-benzyl]oxybenzoic acid Formula: C21H16ClNO6 MolecularWeight: 413.80784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)OCC2=C(C(=CC=C2)OCC3=CC(=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)OCC2=C(C(=CC=C2)OCC3=CC(=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H16ClNO6/c22-16-7-3-5-14(11-16)12-28-19-10-4-6-15(20(19)23(26)27)13-29-18-9-2-1-8-17(18)21(24)25/h1-11H,12-13H2,(H,24,25)