trimethyl-[3-[7-[6-(trifluoromethyl)indol-1-id-2-yl]heptoxycarbonyl]phenyl]azanium

Systemtic Name: trimethyl-[3-[7-[6-(trifluoromethyl)indol-1-id-2-yl]heptoxycarbonyl]phenyl]azanium Openeye Name: trimethyl-[3-[7-[6-(trifluoromethyl)indol-1-id-2-yl]heptoxycarbonyl]phenyl]ammonium CAS Name: trimethyl-[3-[oxo-[7-[6-(trifluoromethyl)-2-indol-1-idyl]heptoxy]methyl]phenyl]ammonium IUPAC Name: trimethyl-[3-[7-[6-(trifluoromethyl)indol-1-id-2-yl]heptoxycarbonyl]phenyl]azanium Traditional Name: trimethyl-[3-[7-[6-(trifluoromethyl)indol-1-id-2-yl]heptoxycarbonyl]phenyl]ammonium Formula: C26H31F3N2O2 MolecularWeight: 460.53175

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1=CC=CC(=C1)C(=O)OCCCCCCCC2=CC3=C([N-]2)C=C(C=C3)C(F)(F)F

Isomeric SMILES

C[N+](C)(C)C1=CC=CC(=C1)C(=O)OCCCCCCCC2=CC3=C([N-]2)C=C(C=C3)C(F)(F)F

InChI

InChI=1S/C26H31F3N2O2/c1-31(2,3)23-12-9-10-20(17-23)25(32)33-15-8-6-4-5-7-11-22-16-19-13-14-21(26(27,28)29)18-24(19)30-22/h9-10,12-14,16-18H,4-8,11,15H2,1-3H3