3-ethoxy-4-[(4-nitrophenyl)methoxy]benzoic acid

Systemtic Name: 3-ethoxy-4-[(4-nitrophenyl)methoxy]benzoic acid Openeye Name: 3-ethoxy-4-[(4-nitrophenyl)methoxy]benzoic acid CAS Name: 3-ethoxy-4-[(4-nitrophenyl)methoxy]benzoic acid IUPAC Name: 3-ethoxy-4-[(4-nitrophenyl)methoxy]benzoic acid Traditional Name: 3-ethoxy-4-(4-nitrobenzyl)oxy-benzoic acid Formula: C16H15NO6 MolecularWeight: 317.2934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H15NO6/c1-2-22-15-9-12(16(18)19)5-8-14(15)23-10-11-3-6-13(7-4-11)17(20)21/h3-9H,2,10H2,1H3,(H,18,19)