tert-butyl 2-methyl-4-(3-methyl-1-benzothiophen-5-yl)-4-oxidanyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl 2-methyl-4-(3-methyl-1-benzothiophen-5-yl)-4-oxidanyl-piperidine-1-carboxylate Openeye Name: tert-butyl 4-hydroxy-2-methyl-4-(3-methylbenzothiophen-5-yl)piperidine-1-carboxylate CAS Name: 4-hydroxy-2-methyl-4-(3-methyl-1-benzothiophen-5-yl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-hydroxy-2-methyl-4-(3-methyl-1-benzothiophen-5-yl)piperidine-1-carboxylate Traditional Name: 4-hydroxy-2-methyl-4-(3-methylbenzothiophen-5-yl)piperidine-1-carboxylic acid tert-butyl ester Formula: C20H27NO3S MolecularWeight: 361.49828

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CCN1C(=O)OC(C)(C)C)(C2=CC3=C(C=C2)SC=C3C)O

Isomeric SMILES

CC1CC(CCN1C(=O)OC(C)(C)C)(C2=CC3=C(C=C2)SC=C3C)O

InChI

InChI=1S/C20H27NO3S/c1-13-12-25-17-7-6-15(10-16(13)17)20(23)8-9-21(14(2)11-20)18(22)24-19(3,4)5/h6-7,10,12,14,23H,8-9,11H2,1-5H3