3-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfonylmethyl]-7-(3-methylpiperidin-1-yl)carbonyl-3,4-dihydro-1H-quinoxalin-2-one

Systemtic Name: 3-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfonylmethyl]-7-(3-methylpiperidin-1-yl)carbonyl-3,4-dihydro-1H-quinoxalin-2-one Openeye Name: 3-[(2-chloro-4-fluoro-phenyl)methylsulfonylmethyl]-7-(3-methylpiperidine-1-carbonyl)-3,4-dihydro-1H-quinoxalin-2-one CAS Name: 3-[(2-chloro-4-fluorophenyl)methylsulfonylmethyl]-7-[(3-methyl-1-piperidinyl)-oxomethyl]-3,4-dihydro-1H-quinoxalin-2-one IUPAC Name: 3-[(2-chloro-4-fluorophenyl)methylsulfonylmethyl]-7-(3-methylpiperidine-1-carbonyl)-3,4-dihydro-1H-quinoxalin-2-one Traditional Name: 3-[(2-chloro-4-fluoro-benzyl)sulfonylmethyl]-7-(3-methylpiperidine-1-carbonyl)-3,4-dihydro-1H-quinoxalin-2-one Formula: C23H25ClFN3O4S MolecularWeight: 493.978703

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2=CC3=C(C=C2)NC(C(=O)N3)CS(=O)(=O)CC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

CC1CCCN(C1)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/C23H25ClFN3O4S/c1-14-3-2-8-28(11-14)23(30)15-5-7-19-20(9-15)27-22(29)21(26-19)13-33(31,32)12-16-4-6-17(25)10-18(16)24/h4-7,9-10,14,21,26H,2-3,8,11-13H2,1H3,(H,27,29)