2-[3-[(2-carboxyphenyl)methylperoxy]propoxycarbonyl]-5-nitro-benzoic acid

Systemtic Name: 2-[3-[(2-carboxyphenyl)methylperoxy]propoxycarbonyl]-5-nitro-benzoic acid Openeye Name: 2-[3-[(2-carboxyphenyl)methylperoxy]propoxycarbonyl]-5-nitro-benzoic acid CAS Name: 2-[3-[(2-carboxyphenyl)methyldioxy]propoxy-oxomethyl]-5-nitrobenzoic acid IUPAC Name: 2-[3-[(2-carboxyphenyl)methylperoxy]propoxycarbonyl]-5-nitrobenzoic acid Traditional Name: 2-[3-(2-carboxybenzyl)peroxypropoxycarbonyl]-5-nitro-benzoic acid Formula: C19H17NO10 MolecularWeight: 419.33898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COOCCCOC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)COOCCCOC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O)C(=O)O

InChI

InChI=1S/C19H17NO10/c21-17(22)14-5-2-1-4-12(14)11-30-29-9-3-8-28-19(25)15-7-6-13(20(26)27)10-16(15)18(23)24/h1-2,4-7,10H,3,8-9,11H2,(H,21,22)(H,23,24)