1-(2-chloranyl-4-morpholin-4-ylsulfonyl-phenyl)piperidine-4-carboxylic acid

Systemtic Name: 1-(2-chloranyl-4-morpholin-4-ylsulfonyl-phenyl)piperidine-4-carboxylic acid Openeye Name: 1-(2-chloro-4-morpholinosulfonyl-phenyl)piperidine-4-carboxylic acid CAS Name: 1-[2-chloro-4-(4-morpholinylsulfonyl)phenyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(2-chloro-4-morpholin-4-ylsulfonylphenyl)piperidine-4-carboxylic acid Traditional Name: 1-(2-chloro-4-morpholinosulfonyl-phenyl)isonipecotic acid Formula: C16H21ClN2O5S MolecularWeight: 388.86634

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)Cl

Isomeric SMILES

C1CN(CCC1C(=O)O)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)Cl

InChI

InChI=1S/C16H21ClN2O5S/c17-14-11-13(25(22,23)19-7-9-24-10-8-19)1-2-15(14)18-5-3-12(4-6-18)16(20)21/h1-2,11-12H,3-10H2,(H,20,21)