O5-[5-aminocarbonyl-1-(3-fluorophenyl)-8-methyl-8-oxidanyl-2-(quinoxalin-2-ylcarbonylamino)nonan-3-yl] O1-ethyl pentanedioate

Systemtic Name: O5-[5-aminocarbonyl-1-(3-fluorophenyl)-8-methyl-8-oxidanyl-2-(quinoxalin-2-ylcarbonylamino)nonan-3-yl] O1-ethyl pentanedioate Openeye Name: O5-[3-carbamoyl-1-[2-(3-fluorophenyl)-1-(quinoxaline-2-carbonylamino)ethyl]-6-hydroxy-6-methyl-heptyl] O1-ethyl pentanedioate CAS Name: pentanedioic acid O5-[5-carbamoyl-1-(3-fluorophenyl)-8-hydroxy-8-methyl-2-[[oxo(2-quinoxalinyl)methyl]amino]nonan-3-yl] ester O1-ethyl ester IUPAC Name: 5-O-[5-carbamoyl-1-(3-fluorophenyl)-8-hydroxy-8-methyl-2-(quinoxaline-2-carbonylamino)nonan-3-yl] 1-O-ethyl pentanedioate Traditional Name: glutaric acid O5-[3-carbamoyl-1-[2-(3-fluorophenyl)-1-(quinoxaline-2-carbonylamino)ethyl]-6-hydroxy-6-methyl-heptyl] ester O1-ethyl ester Formula: C33H41FN4O7 MolecularWeight: 624.699643

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCC(=O)OC(CC(CCC(C)(C)O)C(=O)N)C(CC1=CC(=CC=C1)F)NC(=O)C2=NC3=CC=CC=C3N=C2

Isomeric SMILES

CCOC(=O)CCCC(=O)OC(CC(CCC(C)(C)O)C(=O)N)C(CC1=CC(=CC=C1)F)NC(=O)C2=NC3=CC=CC=C3N=C2

InChI

InChI=1S/C33H41FN4O7/c1-4-44-29(39)13-8-14-30(40)45-28(19-22(31(35)41)15-16-33(2,3)43)26(18-21-9-7-10-23(34)17-21)38-32(42)27-20-36-24-11-5-6-12-25(24)37-27/h5-7,9-12,17,20,22,26,28,43H,4,8,13-16,18-19H2,1-3H3,(H2,35,41)(H,38,42)