2-(3,4-dimethoxyphenyl)ethyl-[(2R)-3-ethoxy-1,1,1-tris(fluoranyl)-2-[(4-methoxyphenyl)carbonylamino]-3-oxidanylidene-propan-2-yl]azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-[(2R)-3-ethoxy-1,1,1-tris(fluoranyl)-2-[(4-methoxyphenyl)carbonylamino]-3-oxidanylidene-propan-2-yl]azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-[(1R)-1-ethoxycarbonyl-2,2,2-trifluoro-1-[(4-methoxybenzoyl)amino]ethyl]ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-[(2R)-3-ethoxy-1,1,1-trifluoro-2-[[(4-methoxyphenyl)-oxomethyl]amino]-3-oxopropan-2-yl]ammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-[(2R)-3-ethoxy-1,1,1-trifluoro-2-[(4-methoxybenzoyl)amino]-3-oxopropan-2-yl]azanium Traditional Name: [(1R)-1-carbethoxy-2,2,2-trifluoro-1-(p-anisoylamino)ethyl]-homoveratryl-ammonium Formula: C23H28F3N2O6+ MolecularWeight: 485.47343

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(F)(F)F)([NH2+]CCC1=CC(=C(C=C1)OC)OC)NC(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)[C@](C(F)(F)F)([NH2+]CCC1=CC(=C(C=C1)OC)OC)NC(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C23H27F3N2O6/c1-5-34-21(30)22(23(24,25)26,28-20(29)16-7-9-17(31-2)10-8-16)27-13-12-15-6-11-18(32-3)19(14-15)33-4/h6-11,14,27H,5,12-13H2,1-4H3,(H,28,29)/p+1/t22-/m0/s1