1-[4-[(5-chloranylthiophen-2-yl)methoxy]phenyl]sulfonyl-5-oxidanyl-piperidine-2-carboxylic acid

Systemtic Name: 1-[4-[(5-chloranylthiophen-2-yl)methoxy]phenyl]sulfonyl-5-oxidanyl-piperidine-2-carboxylic acid Openeye Name: 1-[4-[(5-chloro-2-thienyl)methoxy]phenyl]sulfonyl-5-hydroxy-piperidine-2-carboxylic acid CAS Name: 1-[4-[(5-chloro-2-thiophenyl)methoxy]phenyl]sulfonyl-5-hydroxy-2-piperidinecarboxylic acid IUPAC Name: 1-[4-[(5-chlorothiophen-2-yl)methoxy]phenyl]sulfonyl-5-hydroxypiperidine-2-carboxylic acid Traditional Name: 1-[4-[(5-chloro-2-thienyl)methoxy]phenyl]sulfonyl-5-hydroxy-pipecolinic acid Formula: C17H18ClNO6S2 MolecularWeight: 431.91092

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(CC1O)S(=O)(=O)C2=CC=C(C=C2)OCC3=CC=C(S3)Cl)C(=O)O

Isomeric SMILES

C1CC(N(CC1O)S(=O)(=O)C2=CC=C(C=C2)OCC3=CC=C(S3)Cl)C(=O)O

InChI

InChI=1S/C17H18ClNO6S2/c18-16-8-4-13(26-16)10-25-12-2-5-14(6-3-12)27(23,24)19-9-11(20)1-7-15(19)17(21)22/h2-6,8,11,15,20H,1,7,9-10H2,(H,21,22)