(R)-[1-[2-(4-bromophenyl)sulfonylethyl]piperidin-1-ium-4-yl]-phenyl-methanol

Systemtic Name: (R)-[1-[2-(4-bromophenyl)sulfonylethyl]piperidin-1-ium-4-yl]-phenyl-methanol Openeye Name: (R)-[1-[2-(4-bromophenyl)sulfonylethyl]piperidin-1-ium-4-yl]-phenyl-methanol CAS Name: (R)-[1-[2-(4-bromophenyl)sulfonylethyl]-4-piperidin-1-iumyl]-phenylmethanol IUPAC Name: (R)-[1-[2-(4-bromophenyl)sulfonylethyl]piperidin-1-ium-4-yl]-phenylmethanol Traditional Name: (R)-[1-(2-brosylethyl)piperidin-1-ium-4-yl]-phenyl-methanol Formula: C20H25BrNO3S+ MolecularWeight: 439.3864

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(C2=CC=CC=C2)O)CCS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1C[NH+](CCC1[C@H](C2=CC=CC=C2)O)CCS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H24BrNO3S/c21-18-6-8-19(9-7-18)26(24,25)15-14-22-12-10-17(11-13-22)20(23)16-4-2-1-3-5-16/h1-9,17,20,23H,10-15H2/p+1/t20-/m0/s1