ethyl 1-[1,1-bis(oxidanylidene)-1-benzothiophen-3-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[1,1-bis(oxidanylidene)-1-benzothiophen-3-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-(1,1-dioxobenzothiophen-3-yl)piperidine-4-carboxylate CAS Name: 1-(1,1-dioxo-1-benzothiophen-3-yl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(1,1-dioxo-1-benzothiophen-3-yl)piperidine-4-carboxylate Traditional Name: 1-(1,1-diketobenzothiophen-3-yl)isonipecotic acid ethyl ester Formula: C16H19NO4S MolecularWeight: 321.39136

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=CS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=CS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C16H19NO4S/c1-2-21-16(18)12-7-9-17(10-8-12)14-11-22(19,20)15-6-4-3-5-13(14)15/h3-6,11-12H,2,7-10H2,1H3