(E)-N-[(3aS,4R,5R,6S,7R,7aR)-4,6,7-tris(oxidanyl)-3a,4,5,6,7,7a-hexahydro-1,3-benzodioxol-5-yl]-3-[4-[(2S,3R,4S,5R)-5-[(E)-N-[[2,3-bis(chloranyl)-5-fluoranyl-phenyl]methoxy]-C-methyl-carbonimidoyl]-3,4-bis(oxidanyl)oxolan-2-yl]oxy-3-fluoranyl-phenyl]-2-methyl-prop-2-enamide

Systemtic Name: (E)-N-[(3aS,4R,5R,6S,7R,7aR)-4,6,7-tris(oxidanyl)-3a,4,5,6,7,7a-hexahydro-1,3-benzodioxol-5-yl]-3-[4-[(2S,3R,4S,5R)-5-[(E)-N-[[2,3-bis(chloranyl)-5-fluoranyl-phenyl]methoxy]-C-methyl-carbonimidoyl]-3,4-bis(oxidanyl)oxolan-2-yl]oxy-3-fluoranyl-phenyl]-2-methyl-prop-2-enamide Openeye Name: (E)-N-[(3aS,4R,5R,6S,7R,7aR)-4,6,7-trihydroxy-3a,4,5,6,7,7a-hexahydro-1,3-benzodioxol-5-yl]-3-[4-[(2S,3R,4S,5R)-5-[(E)-N-[(2,3-dichloro-5-fluoro-phenyl)methoxy]-C-methyl-carbonimidoyl]-3,4-dihydroxy-tetrahydrofuran-2-yl]oxy-3-fluoro-phenyl]-2-methyl-prop-2-enamide CAS Name: (E)-N-[(3aS,4R,5R,6S,7R,7aR)-4,6,7-trihydroxy-3a,4,5,6,7,7a-hexahydro-1,3-benzodioxol-5-yl]-3-[4-[[(2S,3R,4S,5R)-5-[(1E)-1-[(2,3-dichloro-5-fluorophenyl)methoxyimino]ethyl]-3,4-dihydroxy-2-oxolanyl]oxy]-3-fluorophenyl]-2-methyl-2-propenamide IUPAC Name: (E)-N-[(3aS,4R,5R,6S,7R,7aR)-4,6,7-trihydroxy-3a,4,5,6,7,7a-hexahydro-1,3-benzodioxol-5-yl]-3-[4-[(2S,3R,4S,5R)-5-[(E)-N-[(2,3-dichloro-5-fluorophenyl)methoxy]-C-methylcarbonimidoyl]-3,4-dihydroxyoxolan-2-yl]oxy-3-fluorophenyl]-2-methylprop-2-enamide Traditional Name: (E)-N-[(3aS,4R,5R,6S,7R,7aR)-4,6,7-trihydroxy-3a,4,5,6,7,7a-hexahydro-1,3-benzodioxol-5-yl]-3-[4-[(2S,3R,4S,5R)-5-[(E)-N-(2,3-dichloro-5-fluoro-benzyl)oxy-C-methyl-carbonimidoyl]-3,4-dihydroxy-tetrahydrofuran-2-yl]oxy-3-fluoro-phenyl]-2-methyl-acrylamide Formula: C30H32Cl2F2N2O11 MolecularWeight: 705.484686

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC(=C(C=C1)OC2C(C(C(O2)C(=NOCC3=CC(=CC(=C3Cl)Cl)F)C)O)O)F)C(=O)NC4C(C(C5C(C4O)OCO5)O)O

Isomeric SMILES

C/C(=C\C1=CC(=C(C=C1)O[C@H]2[C@@H]([C@@H]([C@H](O2)/C(=N/OCC3=CC(=CC(=C3Cl)Cl)F)/C)O)O)F)/C(=O)N[C@@H]4[C@@H]([C@H]([C@@H]5[C@H]([C@@H]4O)OCO5)O)O

InChI

InChI=1S/C30H32Cl2F2N2O11/c1-11(29(42)35-20-21(37)23(39)28-27(22(20)38)43-10-44-28)5-13-3-4-18(17(34)6-13)46-30-25(41)24(40)26(47-30)12(2)36-45-9-14-7-15(33)8-16(31)19(14)32/h3-8,20-28,30,37-41H,9-10H2,1-2H3,(H,35,42)/b11-5+,36-12+/t20-,21+,22-,23-,24+,25-,26-,27+,28-,30-/m1/s1