3-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfonylmethyl]-7-piperidin-1-ylcarbonyl-3,4-dihydro-1H-quinoxalin-2-one

Systemtic Name: 3-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfonylmethyl]-7-piperidin-1-ylcarbonyl-3,4-dihydro-1H-quinoxalin-2-one Openeye Name: 3-[(2-chloro-4-fluoro-phenyl)methylsulfonylmethyl]-7-(piperidine-1-carbonyl)-3,4-dihydro-1H-quinoxalin-2-one CAS Name: 3-[(2-chloro-4-fluorophenyl)methylsulfonylmethyl]-7-[oxo(1-piperidinyl)methyl]-3,4-dihydro-1H-quinoxalin-2-one IUPAC Name: 3-[(2-chloro-4-fluorophenyl)methylsulfonylmethyl]-7-(piperidine-1-carbonyl)-3,4-dihydro-1H-quinoxalin-2-one Traditional Name: 3-[(2-chloro-4-fluoro-benzyl)sulfonylmethyl]-7-(piperidine-1-carbonyl)-3,4-dihydro-1H-quinoxalin-2-one Formula: C22H23ClFN3O4S MolecularWeight: 479.952123

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC3=C(C=C2)NC(C(=O)N3)CS(=O)(=O)CC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC3=C(C=C2)NC(C(=O)N3)CS(=O)(=O)CC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C22H23ClFN3O4S/c23-17-11-16(24)6-4-15(17)12-32(30,31)13-20-21(28)26-19-10-14(5-7-18(19)25-20)22(29)27-8-2-1-3-9-27/h4-7,10-11,20,25H,1-3,8-9,12-13H2,(H,26,28)