butyl 2-methyl-4-oxidanyl-4-[4-(trifluoromethyl)-1-benzothiophen-2-yl]piperidine-1-carboxylate

Systemtic Name: butyl 2-methyl-4-oxidanyl-4-[4-(trifluoromethyl)-1-benzothiophen-2-yl]piperidine-1-carboxylate Openeye Name: butyl 4-hydroxy-2-methyl-4-[4-(trifluoromethyl)benzothiophen-2-yl]piperidine-1-carboxylate CAS Name: 4-hydroxy-2-methyl-4-[4-(trifluoromethyl)-1-benzothiophen-2-yl]-1-piperidinecarboxylic acid butyl ester IUPAC Name: butyl 4-hydroxy-2-methyl-4-[4-(trifluoromethyl)-1-benzothiophen-2-yl]piperidine-1-carboxylate Traditional Name: 4-hydroxy-2-methyl-4-[4-(trifluoromethyl)benzothiophen-2-yl]piperidine-1-carboxylic acid butyl ester Formula: C20H24F3NO3S MolecularWeight: 415.46967

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)N1CCC(CC1C)(C2=CC3=C(C=CC=C3S2)C(F)(F)F)O

Isomeric SMILES

CCCCOC(=O)N1CCC(CC1C)(C2=CC3=C(C=CC=C3S2)C(F)(F)F)O

InChI

InChI=1S/C20H24F3NO3S/c1-3-4-10-27-18(25)24-9-8-19(26,12-13(24)2)17-11-14-15(20(21,22)23)6-5-7-16(14)28-17/h5-7,11,13,26H,3-4,8-10,12H2,1-2H3