2-(3-ethyl-4-nitro-5-oxidanyl-phenyl)ethanoic acid

Systemtic Name: 2-(3-ethyl-4-nitro-5-oxidanyl-phenyl)ethanoic acid Openeye Name: 2-(3-ethyl-5-hydroxy-4-nitro-phenyl)acetic acid CAS Name: 2-(3-ethyl-5-hydroxy-4-nitrophenyl)acetic acid IUPAC Name: 2-(3-ethyl-5-hydroxy-4-nitrophenyl)acetic acid Traditional Name: 2-(3-ethyl-5-hydroxy-4-nitro-phenyl)acetic acid Formula: C10H11NO5 MolecularWeight: 225.19804

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=C1)CC(=O)O)O)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C(=CC(=C1)CC(=O)O)O)[N+](=O)[O-]

InChI

InChI=1S/C10H11NO5/c1-2-7-3-6(5-9(13)14)4-8(12)10(7)11(15)16/h3-4,12H,2,5H2,1H3,(H,13,14)