2-chloranyl-5-piperidin-1-ylsulfonyl-benzoic acid

Systemtic Name: 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoic acid Openeye Name: 2-chloro-5-(1-piperidylsulfonyl)benzoic acid CAS Name: 2-chloro-5-(1-piperidinylsulfonyl)benzoic acid IUPAC Name: 2-chloro-5-piperidin-1-ylsulfonylbenzoic acid Traditional Name: 2-chloro-5-piperidinosulfonyl-benzoic acid Formula: C12H14ClNO4S MolecularWeight: 303.76186

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C12H14ClNO4S/c13-11-5-4-9(8-10(11)12(15)16)19(17,18)14-6-2-1-3-7-14/h4-5,8H,1-3,6-7H2,(H,15,16)