2-[4-(nitrooxymethyl)phenyl]ethanoic acid

Systemtic Name: 2-[4-(nitrooxymethyl)phenyl]ethanoic acid Openeye Name: 2-[4-(nitrooxymethyl)phenyl]acetic acid CAS Name: 2-[4-(nitrooxymethyl)phenyl]acetic acid IUPAC Name: 2-[4-(nitrooxymethyl)phenyl]acetic acid Traditional Name: 2-[4-(nitrooxymethyl)phenyl]acetic acid Formula: C9H9NO5 MolecularWeight: 211.17146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)O)CO[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC(=O)O)CO[N+](=O)[O-]

InChI

InChI=1S/C9H9NO5/c11-9(12)5-7-1-3-8(4-2-7)6-15-10(13)14/h1-4H,5-6H2,(H,11,12)