2-[1-(4-bromanylpiperidin-1-yl)-2-phenyl-ethyl]sulfanylethanoic acid

Systemtic Name: 2-[1-(4-bromanylpiperidin-1-yl)-2-phenyl-ethyl]sulfanylethanoic acid Openeye Name: 2-[1-(4-bromo-1-piperidyl)-2-phenyl-ethyl]sulfanylacetic acid CAS Name: 2-[[1-(4-bromo-1-piperidinyl)-2-phenylethyl]thio]acetic acid IUPAC Name: 2-[1-(4-bromopiperidin-1-yl)-2-phenylethyl]sulfanylacetic acid Traditional Name: 2-[[1-(4-bromopiperidino)-2-phenyl-ethyl]thio]acetic acid Formula: C15H20BrNO2S MolecularWeight: 358.2938

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1Br)C(CC2=CC=CC=C2)SCC(=O)O

Isomeric SMILES

C1CN(CCC1Br)C(CC2=CC=CC=C2)SCC(=O)O

InChI

InChI=1S/C15H20BrNO2S/c16-13-6-8-17(9-7-13)14(20-11-15(18)19)10-12-4-2-1-3-5-12/h1-5,13-14H,6-11H2,(H,18,19)