(3-chloranyl-1-benzothiophen-2-yl)methyl 1-thiophen-2-ylcarbonylpiperidine-4-carboxylate

Systemtic Name: (3-chloranyl-1-benzothiophen-2-yl)methyl 1-thiophen-2-ylcarbonylpiperidine-4-carboxylate Openeye Name: (3-chlorobenzothiophen-2-yl)methyl 1-(thiophene-2-carbonyl)piperidine-4-carboxylate CAS Name: 1-[oxo(thiophen-2-yl)methyl]-4-piperidinecarboxylic acid (3-chloro-1-benzothiophen-2-yl)methyl ester IUPAC Name: (3-chloro-1-benzothiophen-2-yl)methyl 1-(thiophene-2-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(2-thenoyl)isonipecotic acid (3-chlorobenzothiophen-2-yl)methyl ester Formula: C20H18ClNO3S2 MolecularWeight: 419.94482

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC2=C(C3=CC=CC=C3S2)Cl)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1C(=O)OCC2=C(C3=CC=CC=C3S2)Cl)C(=O)C4=CC=CS4

InChI

InChI=1S/C20H18ClNO3S2/c21-18-14-4-1-2-5-15(14)27-17(18)12-25-20(24)13-7-9-22(10-8-13)19(23)16-6-3-11-26-16/h1-6,11,13H,7-10,12H2