N-[(2R,3S,6S,9R,10R)-2-[tert-butyl(dimethyl)silyl]oxy-10-ethyl-9-(hydroxymethyl)-10-methyl-4,7-bis(oxidanylidene)-13-phenylmethoxy-6-propan-2-yl-11-oxa-5,8-diazabicyclo[10.3.1]hexadeca-1(16),12,14-trien-3-yl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[(2R,3S,6S,9R,10R)-2-[tert-butyl(dimethyl)silyl]oxy-10-ethyl-9-(hydroxymethyl)-10-methyl-4,7-bis(oxidanylidene)-13-phenylmethoxy-6-propan-2-yl-11-oxa-5,8-diazabicyclo[10.3.1]hexadeca-1(16),12,14-trien-3-yl]-2-nitro-benzenesulfonamide Openeye Name: N-[(2R,3S,6S,9R,10R)-13-benzyloxy-2-[tert-butyl(dimethyl)silyl]oxy-10-ethyl-9-(hydroxymethyl)-6-isopropyl-10-methyl-4,7-dioxo-11-oxa-5,8-diazabicyclo[10.3.1]hexadeca-1(16),12,14-trien-3-yl]-2-nitro-benzenesulfonamide CAS Name: N-[(2R,3S,6S,9R,10R)-2-[tert-butyl(dimethyl)silyl]oxy-10-ethyl-9-(hydroxymethyl)-10-methyl-4,7-dioxo-13-phenylmethoxy-6-propan-2-yl-11-oxa-5,8-diazabicyclo[10.3.1]hexadeca-1(16),12,14-trien-3-yl]-2-nitrobenzenesulfonamide IUPAC Name: N-[(2R,3S,6S,9R,10R)-2-[tert-butyl(dimethyl)silyl]oxy-10-ethyl-9-(hydroxymethyl)-10-methyl-4,7-dioxo-13-phenylmethoxy-6-propan-2-yl-11-oxa-5,8-diazabicyclo[10.3.1]hexadeca-1(16),12,14-trien-3-yl]-2-nitrobenzenesulfonamide Traditional Name: N-[(2R,3S,6S,9R,10R)-13-benzoxy-2-[tert-butyl(dimethyl)silyl]oxy-10-ethyl-6-isopropyl-4,7-diketo-10-methyl-9-methylol-11-oxa-5,8-diazabicyclo[10.3.1]hexadeca-1(16),12,14-trien-3-yl]-2-nitro-benzenesulfonamide Formula: C39H54N4O10SSi MolecularWeight: 799.01736

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(NC(=O)C(NC(=O)C(C(C2=CC(=C(C=C2)OCC3=CC=CC=C3)O1)O[Si](C)(C)C(C)(C)C)NS(=O)(=O)C4=CC=CC=C4[N+](=O)[O-])C(C)C)CO)C

Isomeric SMILES

CC[C@@]1([C@H](NC(=O)[C@@H](NC(=O)[C@H]([C@@H](C2=CC(=C(C=C2)OCC3=CC=CC=C3)O1)O[Si](C)(C)C(C)(C)C)NS(=O)(=O)C4=CC=CC=C4[N+](=O)[O-])C(C)C)CO)C

InChI

InChI=1S/C39H54N4O10SSi/c1-10-39(7)32(23-44)40-36(45)33(25(2)3)41-37(46)34(42-54(49,50)31-19-15-14-18-28(31)43(47)48)35(53-55(8,9)38(4,5)6)27-20-21-29(30(22-27)52-39)51-24-26-16-12-11-13-17-26/h11-22,25,32-35,42,44H,10,23-24H2,1-9H3,(H,40,45)(H,41,46)/t32-,33+,34+,35-,39-/m1/s1