methyl 5-oxidanyl-9-[[3-(trifluoromethyl)phenyl]methyl]carbazole-4-carboxylate

Systemtic Name: methyl 5-oxidanyl-9-[[3-(trifluoromethyl)phenyl]methyl]carbazole-4-carboxylate Openeye Name: methyl 5-hydroxy-9-[[3-(trifluoromethyl)phenyl]methyl]carbazole-4-carboxylate CAS Name: 5-hydroxy-9-[[3-(trifluoromethyl)phenyl]methyl]-4-carbazolecarboxylic acid methyl ester IUPAC Name: methyl 5-hydroxy-9-[[3-(trifluoromethyl)phenyl]methyl]carbazole-4-carboxylate Traditional Name: 5-hydroxy-9-[3-(trifluoromethyl)benzyl]carbazole-4-carboxylic acid methyl ester Formula: C22H16F3NO3 MolecularWeight: 399.36255

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C(=CC=C1)N(C3=C2C(=CC=C3)O)CC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

COC(=O)C1=C2C(=CC=C1)N(C3=C2C(=CC=C3)O)CC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C22H16F3NO3/c1-29-21(28)15-7-3-8-16-19(15)20-17(9-4-10-18(20)27)26(16)12-13-5-2-6-14(11-13)22(23,24)25/h2-11,27H,12H2,1H3