2-[3-(4-nitrophenoxy)propyl]oxirane-2-carboxylic acid

Systemtic Name: 2-[3-(4-nitrophenoxy)propyl]oxirane-2-carboxylic acid Openeye Name: 2-[3-(4-nitrophenoxy)propyl]oxirane-2-carboxylic acid CAS Name: 2-[3-(4-nitrophenoxy)propyl]-2-oxiranecarboxylic acid IUPAC Name: 2-[3-(4-nitrophenoxy)propyl]oxirane-2-carboxylic acid Traditional Name: 2-[3-(4-nitrophenoxy)propyl]oxirane-2-carboxylic acid Formula: C12H13NO6 MolecularWeight: 267.23472

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Descriptors Computed from Structure

Canonical SMILES:

C1C(O1)(CCCOC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1C(O1)(CCCOC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C12H13NO6/c14-11(15)12(8-19-12)6-1-7-18-10-4-2-9(3-5-10)13(16)17/h2-5H,1,6-8H2,(H,14,15)