2-[2-nitro-5-(2-phenylmethoxyethoxy)phenyl]ethanoic acid

Systemtic Name: 2-[2-nitro-5-(2-phenylmethoxyethoxy)phenyl]ethanoic acid Openeye Name: 2-[5-(2-benzyloxyethoxy)-2-nitro-phenyl]acetic acid CAS Name: 2-[2-nitro-5-(2-phenylmethoxyethoxy)phenyl]acetic acid IUPAC Name: 2-[2-nitro-5-(2-phenylmethoxyethoxy)phenyl]acetic acid Traditional Name: 2-[5-(2-benzoxyethoxy)-2-nitro-phenyl]acetic acid Formula: C17H17NO6 MolecularWeight: 331.31998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO6/c19-17(20)11-14-10-15(6-7-16(14)18(21)22)24-9-8-23-12-13-4-2-1-3-5-13/h1-7,10H,8-9,11-12H2,(H,19,20)