(3S,6R,7S)-N3-[2-[[2,4-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl]-6-(2-methylpropyl)-N7-oxidanyl-5-oxidanylidene-11-oxa-4-azabicyclo[10.2.2]hexadeca-1(14),12,15-triene-3,7-dicarboxamide

Systemtic Name: (3S,6R,7S)-N3-[2-[[2,4-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl]-6-(2-methylpropyl)-N7-oxidanyl-5-oxidanylidene-11-oxa-4-azabicyclo[10.2.2]hexadeca-1(14),12,15-triene-3,7-dicarboxamide Openeye Name: (3S,6R,7S)-N-[2-(2,4-difluoroanilino)-2-oxo-ethyl]-7-(hydroxycarbamoyl)-6-isobutyl-5-oxo-11-oxa-4-azabicyclo[10.2.2]hexadeca-1(14),12,15-triene-3-carboxamide CAS Name: (3S,6R,7S)-N3-[2-(2,4-difluoroanilino)-2-oxoethyl]-N7-hydroxy-6-(2-methylpropyl)-5-oxo-11-oxa-4-azabicyclo[10.2.2]hexadeca-1(14),12,15-triene-3,7-dicarboxamide IUPAC Name: (3S,6R,7S)-3-N-[2-(2,4-difluoroanilino)-2-oxoethyl]-7-N-hydroxy-6-(2-methylpropyl)-5-oxo-11-oxa-4-azabicyclo[10.2.2]hexadeca-1(14),12,15-triene-3,7-dicarboxamide Traditional Name: (3S,6R,7S)-N-[2-(2,4-difluoroanilino)-2-keto-ethyl]-7-(hydroxycarbamoyl)-6-isobutyl-5-keto-11-oxa-4-azabicyclo[10.2.2]hexadeca-1(14),12,15-triene-3-carboxamide Formula: C28H34F2N4O6 MolecularWeight: 560.589566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C(CCCOC2=CC=C(CC(NC1=O)C(=O)NCC(=O)NC3=C(C=C(C=C3)F)F)C=C2)C(=O)NO

Isomeric SMILES

CC(C)C[C@@H]1[C@H](CCCOC2=CC=C(C[C@H](NC1=O)C(=O)NCC(=O)NC3=C(C=C(C=C3)F)F)C=C2)C(=O)NO

InChI

InChI=1S/C28H34F2N4O6/c1-16(2)12-21-20(27(37)34-39)4-3-11-40-19-8-5-17(6-9-19)13-24(33-26(21)36)28(38)31-15-25(35)32-23-10-7-18(29)14-22(23)30/h5-10,14,16,20-21,24,39H,3-4,11-13,15H2,1-2H3,(H,31,38)(H,32,35)(H,33,36)(H,34,37)/t20-,21+,24-/m0/s1