(phenylmethyl) 6-(trifluoromethyl)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylate

Systemtic Name: (phenylmethyl) 6-(trifluoromethyl)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylate Openeye Name: benzyl 6-(trifluoromethyl)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylate CAS Name: 6-(trifluoromethyl)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-(trifluoromethyl)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylate Traditional Name: 6-(trifluoromethyl)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylic acid benzyl ester Formula: C21H18F3NO2 MolecularWeight: 373.36833

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1C(=O)OCC3=CC=CC=C3)C4=C(N2)C=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CC2=C(CC1C(=O)OCC3=CC=CC=C3)C4=C(N2)C=CC(=C4)C(F)(F)F

InChI

InChI=1S/C21H18F3NO2/c22-21(23,24)15-7-9-19-17(11-15)16-10-14(6-8-18(16)25-19)20(26)27-12-13-4-2-1-3-5-13/h1-5,7,9,11,14,25H,6,8,10,12H2