2-[7-[4-(trifluoromethyl)phenoxy]heptyl]oxirane-2-carboxylic acid

Systemtic Name: 2-[7-[4-(trifluoromethyl)phenoxy]heptyl]oxirane-2-carboxylic acid Openeye Name: 2-[7-[4-(trifluoromethyl)phenoxy]heptyl]oxirane-2-carboxylic acid CAS Name: 2-[7-[4-(trifluoromethyl)phenoxy]heptyl]-2-oxiranecarboxylic acid IUPAC Name: 2-[7-[4-(trifluoromethyl)phenoxy]heptyl]oxirane-2-carboxylic acid Traditional Name: 2-[7-[4-(trifluoromethyl)phenoxy]heptyl]oxirane-2-carboxylic acid Formula: C17H21F3O4 MolecularWeight: 346.34145

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Descriptors Computed from Structure

Canonical SMILES:

C1C(O1)(CCCCCCCOC2=CC=C(C=C2)C(F)(F)F)C(=O)O

Isomeric SMILES

C1C(O1)(CCCCCCCOC2=CC=C(C=C2)C(F)(F)F)C(=O)O

InChI

InChI=1S/C17H21F3O4/c18-17(19,20)13-6-8-14(9-7-13)23-11-5-3-1-2-4-10-16(12-24-16)15(21)22/h6-9H,1-5,10-12H2,(H,21,22)