(2-methoxyphenyl) 1-(5-bromanylthiophen-2-yl)sulfonylpiperidine-3-carboxylate

Systemtic Name: (2-methoxyphenyl) 1-(5-bromanylthiophen-2-yl)sulfonylpiperidine-3-carboxylate Openeye Name: (2-methoxyphenyl) 1-[(5-bromo-2-thienyl)sulfonyl]piperidine-3-carboxylate CAS Name: 1-[(5-bromo-2-thiophenyl)sulfonyl]-3-piperidinecarboxylic acid (2-methoxyphenyl) ester IUPAC Name: (2-methoxyphenyl) 1-(5-bromothiophen-2-yl)sulfonylpiperidine-3-carboxylate Traditional Name: 1-[(5-bromo-2-thienyl)sulfonyl]nipecotic acid (2-methoxyphenyl) ester Formula: C17H18BrNO5S2 MolecularWeight: 460.36252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

COC1=CC=CC=C1OC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C17H18BrNO5S2/c1-23-13-6-2-3-7-14(13)24-17(20)12-5-4-10-19(11-12)26(21,22)16-9-8-15(18)25-16/h2-3,6-9,12H,4-5,10-11H2,1H3