[2-phenylmethoxy-6-(trifluoromethylsulfonyloxy)-7,8,9,10-tetrahydrophenanthridin-3-yl] ethanoate

Systemtic Name: [2-phenylmethoxy-6-(trifluoromethylsulfonyloxy)-7,8,9,10-tetrahydrophenanthridin-3-yl] ethanoate Openeye Name: [2-benzyloxy-6-(trifluoromethylsulfonyloxy)-7,8,9,10-tetrahydrophenanthridin-3-yl] acetate CAS Name: acetic acid [2-phenylmethoxy-6-(trifluoromethylsulfonyloxy)-7,8,9,10-tetrahydrophenanthridin-3-yl] ester IUPAC Name: [2-phenylmethoxy-6-(trifluoromethylsulfonyloxy)-7,8,9,10-tetrahydrophenanthridin-3-yl] acetate Traditional Name: acetic acid (2-benzoxy-6-triflyloxy-7,8,9,10-tetrahydrophenanthridin-3-yl) ester Formula: C23H20F3NO6S MolecularWeight: 495.46821

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C2C3=C(CCCC3)C(=NC2=C1)OS(=O)(=O)C(F)(F)F)OCC4=CC=CC=C4

Isomeric SMILES

CC(=O)OC1=C(C=C2C3=C(CCCC3)C(=NC2=C1)OS(=O)(=O)C(F)(F)F)OCC4=CC=CC=C4

InChI

InChI=1S/C23H20F3NO6S/c1-14(28)32-21-12-19-18(11-20(21)31-13-15-7-3-2-4-8-15)16-9-5-6-10-17(16)22(27-19)33-34(29,30)23(24,25)26/h2-4,7-8,11-12H,5-6,9-10,13H2,1H3