N-[(2S,3S)-8-fluoranyl-8-methyl-3-oxidanyl-1-phenyl-5-[(phenylmethyl)carbamoyl]nonan-2-yl]quinoxaline-2-carboxamide

Systemtic Name: N-[(2S,3S)-8-fluoranyl-8-methyl-3-oxidanyl-1-phenyl-5-[(phenylmethyl)carbamoyl]nonan-2-yl]quinoxaline-2-carboxamide Openeye Name: N-[(1S,2S)-1-benzyl-4-(benzylcarbamoyl)-7-fluoro-2-hydroxy-7-methyl-octyl]quinoxaline-2-carboxamide CAS Name: N-[(2S,3S)-8-fluoro-3-hydroxy-8-methyl-5-[oxo-[(phenylmethyl)amino]methyl]-1-phenylnonan-2-yl]-2-quinoxalinecarboxamide IUPAC Name: N-[(2S,3S)-5-(benzylcarbamoyl)-8-fluoro-3-hydroxy-8-methyl-1-phenylnonan-2-yl]quinoxaline-2-carboxamide Traditional Name: N-[(1S,2S)-1-benzyl-4-(benzylcarbamoyl)-7-fluoro-2-hydroxy-7-methyl-octyl]quinoxaline-2-carboxamide Formula: C33H37FN4O3 MolecularWeight: 556.670283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC(CC(C(CC1=CC=CC=C1)NC(=O)C2=NC3=CC=CC=C3N=C2)O)C(=O)NCC4=CC=CC=C4)F

Isomeric SMILES

CC(C)(CCC(C[C@@H]([C@H](CC1=CC=CC=C1)NC(=O)C2=NC3=CC=CC=C3N=C2)O)C(=O)NCC4=CC=CC=C4)F

InChI

InChI=1S/C33H37FN4O3/c1-33(2,34)18-17-25(31(40)36-21-24-13-7-4-8-14-24)20-30(39)28(19-23-11-5-3-6-12-23)38-32(41)29-22-35-26-15-9-10-16-27(26)37-29/h3-16,22,25,28,30,39H,17-21H2,1-2H3,(H,36,40)(H,38,41)/t25?,28-,30-/m0/s1