2-(3-nitro-4-prop-2-enoxy-phenyl)butanoic acid

Systemtic Name: 2-(3-nitro-4-prop-2-enoxy-phenyl)butanoic acid Openeye Name: 2-(4-allyloxy-3-nitro-phenyl)butanoic acid CAS Name: 2-(3-nitro-4-prop-2-enoxyphenyl)butanoic acid IUPAC Name: 2-(3-nitro-4-prop-2-enoxyphenyl)butanoic acid Traditional Name: 2-(4-allyloxy-3-nitro-phenyl)butyric acid Formula: C13H15NO5 MolecularWeight: 265.2619

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO5/c1-3-7-19-12-6-5-9(8-11(12)14(17)18)10(4-2)13(15)16/h3,5-6,8,10H,1,4,7H2,2H3,(H,15,16)