5-(2-methylbutoxy)-2-(4-nitrophenoxy)carbonyl-benzoic acid

Systemtic Name: 5-(2-methylbutoxy)-2-(4-nitrophenoxy)carbonyl-benzoic acid Openeye Name: 5-(2-methylbutoxy)-2-(4-nitrophenoxy)carbonyl-benzoic acid CAS Name: 5-(2-methylbutoxy)-2-[(4-nitrophenoxy)-oxomethyl]benzoic acid IUPAC Name: 5-(2-methylbutoxy)-2-(4-nitrophenoxy)carbonylbenzoic acid Traditional Name: 5-(2-methylbutoxy)-2-(4-nitrophenoxy)carbonyl-benzoic acid Formula: C19H19NO7 MolecularWeight: 373.35666

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)COC1=CC(=C(C=C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CCC(C)COC1=CC(=C(C=C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C19H19NO7/c1-3-12(2)11-26-15-8-9-16(17(10-15)18(21)22)19(23)27-14-6-4-13(5-7-14)20(24)25/h4-10,12H,3,11H2,1-2H3,(H,21,22)