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

Systemtic Name: tert-butyl 4-(4-ethyl-1-benzothiophen-2-yl)-2-methyl-4-oxidanyl-piperidine-1-carboxylate Openeye Name: tert-butyl 4-(4-ethylbenzothiophen-2-yl)-4-hydroxy-2-methyl-piperidine-1-carboxylate CAS Name: 4-(4-ethyl-1-benzothiophen-2-yl)-4-hydroxy-2-methyl-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-ethyl-1-benzothiophen-2-yl)-4-hydroxy-2-methylpiperidine-1-carboxylate Traditional Name: 4-(4-ethylbenzothiophen-2-yl)-4-hydroxy-2-methyl-piperidine-1-carboxylic acid tert-butyl ester Formula: C21H29NO3S MolecularWeight: 375.52486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C=C(SC2=CC=C1)C3(CCN(C(C3)C)C(=O)OC(C)(C)C)O

Isomeric SMILES

CCC1=C2C=C(SC2=CC=C1)C3(CCN(C(C3)C)C(=O)OC(C)(C)C)O

InChI

InChI=1S/C21H29NO3S/c1-6-15-8-7-9-17-16(15)12-18(26-17)21(24)10-11-22(14(2)13-21)19(23)25-20(3,4)5/h7-9,12,14,24H,6,10-11,13H2,1-5H3