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

Systemtic Name: tert-butyl 4-(4-chloranyl-1-benzothiophen-2-yl)-4-oxidanyl-piperidine-1-carboxylate Openeye Name: tert-butyl 4-(4-chlorobenzothiophen-2-yl)-4-hydroxy-piperidine-1-carboxylate CAS Name: 4-(4-chloro-1-benzothiophen-2-yl)-4-hydroxy-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-chloro-1-benzothiophen-2-yl)-4-hydroxypiperidine-1-carboxylate Traditional Name: 4-(4-chlorobenzothiophen-2-yl)-4-hydroxy-piperidine-1-carboxylic acid tert-butyl ester Formula: C18H22ClNO3S MolecularWeight: 367.89018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)(C2=CC3=C(S2)C=CC=C3Cl)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)(C2=CC3=C(S2)C=CC=C3Cl)O

InChI

InChI=1S/C18H22ClNO3S/c1-17(2,3)23-16(21)20-9-7-18(22,8-10-20)15-11-12-13(19)5-4-6-14(12)24-15/h4-6,11,22H,7-10H2,1-3H3