(4S,7S,10S)-4-(2-azanyl-2-oxidanylidene-ethyl)-17-fluoranyl-7-(hydroxymethyl)-19-nitro-2,5,8-tris(oxidanylidene)-3,6,9,15-tetrazabicyclo[14.4.0]icosa-1(16),17,19-triene-10-carboxamide

Systemtic Name: (4S,7S,10S)-4-(2-azanyl-2-oxidanylidene-ethyl)-17-fluoranyl-7-(hydroxymethyl)-19-nitro-2,5,8-tris(oxidanylidene)-3,6,9,15-tetrazabicyclo[14.4.0]icosa-1(16),17,19-triene-10-carboxamide Openeye Name: (4S,7S,10S)-4-(2-amino-2-oxo-ethyl)-17-fluoro-7-(hydroxymethyl)-19-nitro-2,5,8-trioxo-3,6,9,15-tetrazabicyclo[14.4.0]icosa-1(16),17,19-triene-10-carboxamide CAS Name: (4S,7S,10S)-4-(2-amino-2-oxoethyl)-17-fluoro-7-(hydroxymethyl)-19-nitro-2,5,8-trioxo-3,6,9,15-tetrazabicyclo[14.4.0]eicosa-1(16),17,19-triene-10-carboxamide IUPAC Name: (4S,7S,10S)-4-(2-amino-2-oxoethyl)-17-fluoro-7-(hydroxymethyl)-19-nitro-2,5,8-trioxo-3,6,9,15-tetrazabicyclo[14.4.0]icosa-1(16),17,19-triene-10-carboxamide Traditional Name: (4S,7S,10S)-4-(2-amino-2-keto-ethyl)-17-fluoro-2,5,8-triketo-7-methylol-19-nitro-3,6,9,15-tetrazabicyclo[14.4.0]eicosa-1(16),17,19-triene-10-carboxamide Formula: C20H26FN7O8 MolecularWeight: 511.460943

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC2=C(C=C(C=C2C(=O)NC(C(=O)NC(C(=O)NC(C1)C(=O)N)CO)CC(=O)N)[N+](=O)[O-])F

Isomeric SMILES

C1CCNC2=C(C=C(C=C2C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C1)C(=O)N)CO)CC(=O)N)[N+](=O)[O-])F

InChI

InChI=1S/C20H26FN7O8/c21-11-6-9(28(35)36)5-10-16(11)24-4-2-1-3-12(17(23)31)25-20(34)14(8-29)27-19(33)13(7-15(22)30)26-18(10)32/h5-6,12-14,24,29H,1-4,7-8H2,(H2,22,30)(H2,23,31)(H,25,34)(H,26,32)(H,27,33)/t12-,13-,14-/m0/s1