4-chloranyl-3-(4-oxidanylpiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: 4-chloranyl-3-(4-oxidanylpiperidin-1-yl)sulfonyl-benzoate Openeye Name: 4-chloro-3-[(4-hydroxy-1-piperidyl)sulfonyl]benzoate CAS Name: 4-chloro-3-[(4-hydroxy-1-piperidinyl)sulfonyl]benzoate IUPAC Name: 4-chloro-3-(4-hydroxypiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-chloro-3-(4-hydroxypiperidino)sulfonyl-benzoate Formula: C12H13ClNO5S- MolecularWeight: 318.75332

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)S(=O)(=O)C2=C(C=CC(=C2)C(=O)[O-])Cl

Isomeric SMILES

C1CN(CCC1O)S(=O)(=O)C2=C(C=CC(=C2)C(=O)[O-])Cl

InChI

InChI=1S/C12H14ClNO5S/c13-10-2-1-8(12(16)17)7-11(10)20(18,19)14-5-3-9(15)4-6-14/h1-2,7,9,15H,3-6H2,(H,16,17)/p-1