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

Systemtic Name: butyl 4-(4-ethyl-1-benzothiophen-2-yl)-2-methyl-4-oxidanyl-piperidine-1-carboxylate Openeye Name: 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 butyl ester IUPAC Name: 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 butyl ester Formula: C21H29NO3S MolecularWeight: 375.52486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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