3-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-phenylsulfanyl-propanoic acid

Systemtic Name: 3-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-phenylsulfanyl-propanoic acid Openeye Name: 3-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-phenylsulfanyl-propanoic acid CAS Name: 3-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(phenylthio)propanoic acid IUPAC Name: 3-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-phenylsulfanylpropanoic acid Traditional Name: 3-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(phenylthio)propionic acid Formula: C17H23NO2S MolecularWeight: 305.43502

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCC1CC(C2)CC(C(=O)O)SC3=CC=CC=C3

Isomeric SMILES

CN1C2CCC1CC(C2)CC(C(=O)O)SC3=CC=CC=C3

InChI

InChI=1S/C17H23NO2S/c1-18-13-7-8-14(18)10-12(9-13)11-16(17(19)20)21-15-5-3-2-4-6-15/h2-6,12-14,16H,7-11H2,1H3,(H,19,20)