(1S,3S,4R)-3-(6-chloranylpyridin-3-yl)-7-(4-methylphenyl)sulfonyl-7-azabicyclo[2.2.1]heptan-3-ol

Systemtic Name: (1S,3S,4R)-3-(6-chloranylpyridin-3-yl)-7-(4-methylphenyl)sulfonyl-7-azabicyclo[2.2.1]heptan-3-ol Openeye Name: (1S,3S,4R)-3-(6-chloro-3-pyridyl)-7-(p-tolylsulfonyl)-7-azabicyclo[2.2.1]heptan-3-ol CAS Name: (1S,3S,4R)-3-(6-chloro-3-pyridinyl)-7-(4-methylphenyl)sulfonyl-7-azabicyclo[2.2.1]heptan-3-ol IUPAC Name: (1S,3S,4R)-3-(6-chloropyridin-3-yl)-7-(4-methylphenyl)sulfonyl-7-azabicyclo[2.2.1]heptan-3-ol Traditional Name: (1S,3S,4R)-3-(6-chloro-3-pyridyl)-7-tosyl-7-azabicyclo[2.2.1]heptan-3-ol Formula: C18H19ClN2O3S MolecularWeight: 378.87306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3CCC2C(C3)(C4=CN=C(C=C4)Cl)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@H]3CC[C@@H]2[C@](C3)(C4=CN=C(C=C4)Cl)O

InChI

InChI=1S/C18H19ClN2O3S/c1-12-2-6-15(7-3-12)25(23,24)21-14-5-8-16(21)18(22,10-14)13-4-9-17(19)20-11-13/h2-4,6-7,9,11,14,16,22H,5,8,10H2,1H3/t14-,16+,18-/m0/s1