(3R)-1-(4-bromophenyl)sulfonylpiperidine-3-carboxylate

Systemtic Name: (3R)-1-(4-bromophenyl)sulfonylpiperidine-3-carboxylate Openeye Name: (3R)-1-(4-bromophenyl)sulfonylpiperidine-3-carboxylate CAS Name: (3R)-1-(4-bromophenyl)sulfonyl-3-piperidinecarboxylate IUPAC Name: (3R)-1-(4-bromophenyl)sulfonylpiperidine-3-carboxylate Traditional Name: (3R)-1-brosylnipecotate Formula: C12H13BrNO4S- MolecularWeight: 347.20492

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)[O-]

Isomeric SMILES

C1C[C@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)[O-]

InChI

InChI=1S/C12H14BrNO4S/c13-10-3-5-11(6-4-10)19(17,18)14-7-1-2-9(8-14)12(15)16/h3-6,9H,1-2,7-8H2,(H,15,16)/p-1/t9-/m1/s1