2-(3-nitro-4-oxidanyl-phenyl)propanoate

Systemtic Name: 2-(3-nitro-4-oxidanyl-phenyl)propanoate Openeye Name: 2-(4-hydroxy-3-nitro-phenyl)propanoate CAS Name: 2-(4-hydroxy-3-nitrophenyl)propanoate IUPAC Name: 2-(4-hydroxy-3-nitrophenyl)propanoate Traditional Name: 2-(4-hydroxy-3-nitro-phenyl)propionate Formula: C9H8NO5- MolecularWeight: 210.16352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9NO5/c1-5(9(12)13)6-2-3-8(11)7(4-6)10(14)15/h2-5,11H,1H3,(H,12,13)/p-1