carboxymethyl-(4-methoxycarbonylcyclohex-3-en-1-yl)-methyl-azanium; 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: carboxymethyl-(4-methoxycarbonylcyclohex-3-en-1-yl)-methyl-azanium; 2,2,2-tris(fluoranyl)ethanoate Openeye Name: carboxymethyl-(4-methoxycarbonylcyclohex-3-en-1-yl)-methyl-ammonium; 2,2,2-trifluoroacetate CAS Name: carboxymethyl-(4-methoxycarbonyl-1-cyclohex-3-enyl)-methylammonium; 2,2,2-trifluoroacetate IUPAC Name: carboxymethyl-(4-methoxycarbonylcyclohex-3-en-1-yl)-methylazanium; 2,2,2-trifluoroacetate Traditional Name: (4-carbomethoxycyclohex-3-en-1-yl)-(carboxymethyl)-methyl-ammonium; 2,2,2-trifluoroacetate Formula: C13H18F3NO6 MolecularWeight: 341.28033

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC(=O)O)C1CCC(=CC1)C(=O)OC.C(=O)(C(F)(F)F)[O-]

Isomeric SMILES

C[NH+](CC(=O)O)C1CCC(=CC1)C(=O)OC.C(=O)(C(F)(F)F)[O-]

InChI

InChI=1S/C11H17NO4.C2HF3O2/c1-12(7-10(13)14)9-5-3-8(4-6-9)11(15)16-2;3-2(4,5)1(6)7/h3,9H,4-7H2,1-2H3,(H,13,14);(H,6,7)