4-[1-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfonyl]piperidin-4-yl]carbonyl-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[1-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfonyl]piperidin-4-yl]carbonyl-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[1-[(2-chloro-6-fluoro-phenyl)methylsulfonyl]piperidine-4-carbonyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[[1-[(2-chloro-6-fluorophenyl)methylsulfonyl]-4-piperidinyl]-oxomethyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[1-[(2-chloro-6-fluorophenyl)methylsulfonyl]piperidine-4-carbonyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[1-(2-chloro-6-fluoro-benzyl)sulfonylisonipecotoyl]-1,3-dihydroquinoxalin-2-one Formula: C21H21ClFN3O4S MolecularWeight: 465.925543

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CC(=O)NC3=CC=CC=C32)S(=O)(=O)CC4=C(C=CC=C4Cl)F

Isomeric SMILES

C1CN(CCC1C(=O)N2CC(=O)NC3=CC=CC=C32)S(=O)(=O)CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C21H21ClFN3O4S/c22-16-4-3-5-17(23)15(16)13-31(29,30)25-10-8-14(9-11-25)21(28)26-12-20(27)24-18-6-1-2-7-19(18)26/h1-7,14H,8-13H2,(H,24,27)