2-nitro-5-(2-phenylmethoxyethoxy)benzoic acid

Systemtic Name: 2-nitro-5-(2-phenylmethoxyethoxy)benzoic acid Openeye Name: 5-(2-benzyloxyethoxy)-2-nitro-benzoic acid CAS Name: 2-nitro-5-(2-phenylmethoxyethoxy)benzoic acid IUPAC Name: 2-nitro-5-(2-phenylmethoxyethoxy)benzoic acid Traditional Name: 5-(2-benzoxyethoxy)-2-nitro-benzoic acid Formula: C16H15NO6 MolecularWeight: 317.2934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCOC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COCCOC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

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