N-[3-chloranyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-1-methylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-[3-chloranyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-1-methylsulfonyl-piperidine-2-carboxamide Openeye Name: N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-1-methylsulfonyl-piperidine-2-carboxamide CAS Name: N-[3-chloro-4-(2-oxo-1-pyrrolidinyl)phenyl]-1-methylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-1-methylsulfonylpiperidine-2-carboxamide Traditional Name: N-[3-chloro-4-(2-ketopyrrolidino)phenyl]-1-mesyl-pipecolinamide Formula: C17H22ClN3O4S MolecularWeight: 399.89228

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCCC1C(=O)NC2=CC(=C(C=C2)N3CCCC3=O)Cl

Isomeric SMILES

CS(=O)(=O)N1CCCCC1C(=O)NC2=CC(=C(C=C2)N3CCCC3=O)Cl

InChI

InChI=1S/C17H22ClN3O4S/c1-26(24,25)21-10-3-2-5-15(21)17(23)19-12-7-8-14(13(18)11-12)20-9-4-6-16(20)22/h7-8,11,15H,2-6,9-10H2,1H3,(H,19,23)