(3-ethoxy-7-oxidanyl-1,1-dipropyl-3,4-dihydro-2H-naphthalen-2-yl)azanium; 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: (3-ethoxy-7-oxidanyl-1,1-dipropyl-3,4-dihydro-2H-naphthalen-2-yl)azanium; 2,2,2-tris(fluoranyl)ethanoate Openeye Name: (3-ethoxy-7-hydroxy-1,1-dipropyl-tetralin-2-yl)ammonium; 2,2,2-trifluoroacetate CAS Name: (3-ethoxy-7-hydroxy-1,1-dipropyl-3,4-dihydro-2H-naphthalen-2-yl)ammonium; 2,2,2-trifluoroacetate IUPAC Name: (3-ethoxy-7-hydroxy-1,1-dipropyl-3,4-dihydro-2H-naphthalen-2-yl)azanium; 2,2,2-trifluoroacetate Traditional Name: (3-ethoxy-7-hydroxy-1,1-dipropyl-tetralin-2-yl)ammonium; 2,2,2-trifluoroacetate Formula: C20H30F3NO4 MolecularWeight: 405.45171

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(C(CC2=C1C=C(C=C2)O)OCC)[NH3+])CCC.C(=O)(C(F)(F)F)[O-]

Isomeric SMILES

CCCC1(C(C(CC2=C1C=C(C=C2)O)OCC)[NH3+])CCC.C(=O)(C(F)(F)F)[O-]

InChI

InChI=1S/C18H29NO2.C2HF3O2/c1-4-9-18(10-5-2)15-12-14(20)8-7-13(15)11-16(17(18)19)21-6-3;3-2(4,5)1(6)7/h7-8,12,16-17,20H,4-6,9-11,19H2,1-3H3;(H,6,7)