phenyl 1-(5-bromanylthiophen-2-yl)sulfonylpiperidine-4-carboxylate

Systemtic Name: phenyl 1-(5-bromanylthiophen-2-yl)sulfonylpiperidine-4-carboxylate Openeye Name: phenyl 1-[(5-bromo-2-thienyl)sulfonyl]piperidine-4-carboxylate CAS Name: 1-[(5-bromo-2-thiophenyl)sulfonyl]-4-piperidinecarboxylic acid phenyl ester IUPAC Name: phenyl 1-(5-bromothiophen-2-yl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-[(5-bromo-2-thienyl)sulfonyl]isonipecotic acid phenyl ester Formula: C16H16BrNO4S2 MolecularWeight: 430.33654

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OC2=CC=CC=C2)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

C1CN(CCC1C(=O)OC2=CC=CC=C2)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C16H16BrNO4S2/c17-14-6-7-15(23-14)24(20,21)18-10-8-12(9-11-18)16(19)22-13-4-2-1-3-5-13/h1-7,12H,8-11H2