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Amb10069313

Duplicate ID
CAS Number 1000018-47-2
Molecule Name 4-Methylsulfonyl-3-(piperidin-1-yl)benzoic acid
4-Methylsulfonyl-3-(piperidin-1-yl)benzoic acid
4-(Methylsulphonyl)-3-piperidin-1-ylbenzoic acid
SmilesOC(=O)c1ccc(c(c1)N1CCCCC1)S(=O)(=O)C
InchiKeyCBYNXNKBSCPATK-UHFFFAOYSA-N
InChi InChI=1S/C13H17NO4S/c1-19(17,18)12-6-5-10(13(15)16)9-11(12)14-7-3-2-4-8-14/h5-6,9H,2-4,7-8H2,1H3,(H,15,16)
Formula C13H17NO4S
Molecular weight 283.343
Rings 2
logP 2.9244
PSA 83.06
MR 75.9443
Building Block
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