5-nitro-2-oxidanyl-3-prop-2-enyl-benzoic acid

Systemtic Name: 5-nitro-2-oxidanyl-3-prop-2-enyl-benzoic acid Openeye Name: 3-allyl-2-hydroxy-5-nitro-benzoic acid CAS Name: 2-hydroxy-5-nitro-3-prop-2-enylbenzoic acid IUPAC Name: 2-hydroxy-5-nitro-3-prop-2-enylbenzoic acid Traditional Name: 3-allyl-2-hydroxy-5-nitro-benzoic acid Formula: C10H9NO5 MolecularWeight: 223.18216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9NO5/c1-2-3-6-4-7(11(15)16)5-8(9(6)12)10(13)14/h2,4-5,12H,1,3H2,(H,13,14)