[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(2S,3R)-4-[1,3-benzodioxol-5-ylsulfonyl(2-methylpropyl)amino]-1-[4-(4-methoxyphenoxy)phenyl]-3-oxidanyl-butan-2-yl]carbamate

Systemtic Name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(2S,3R)-4-[1,3-benzodioxol-5-ylsulfonyl(2-methylpropyl)amino]-1-[4-(4-methoxyphenoxy)phenyl]-3-oxidanyl-butan-2-yl]carbamate Openeye Name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(1S,2R)-3-[1,3-benzodioxol-5-ylsulfonyl(isobutyl)amino]-2-hydroxy-1-[[4-(4-methoxyphenoxy)phenyl]methyl]propyl]carbamate CAS Name: N-[(2S,3R)-4-[1,3-benzodioxol-5-ylsulfonyl(2-methylpropyl)amino]-3-hydroxy-1-[4-(4-methoxyphenoxy)phenyl]butan-2-yl]carbamic acid [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ester IUPAC Name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(2S,3R)-4-[1,3-benzodioxol-5-ylsulfonyl(2-methylpropyl)amino]-3-hydroxy-1-[4-(4-methoxyphenoxy)phenyl]butan-2-yl]carbamate Traditional Name: N-[(1S,2R)-3-[1,3-benzodioxol-5-ylsulfonyl(isobutyl)amino]-2-hydroxy-1-[4-(4-methoxyphenoxy)benzyl]propyl]carbamic acid [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ester Formula: C35H42N2O11S MolecularWeight: 698.77978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C(CC1=CC=C(C=C1)OC2=CC=C(C=C2)OC)NC(=O)OC3COC4C3CCO4)O)S(=O)(=O)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

CC(C)CN(C[C@H]([C@H](CC1=CC=C(C=C1)OC2=CC=C(C=C2)OC)NC(=O)O[C@H]3CO[C@@H]4[C@H]3CCO4)O)S(=O)(=O)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C35H42N2O11S/c1-22(2)18-37(49(40,41)27-12-13-31-32(17-27)46-21-45-31)19-30(38)29(36-35(39)48-33-20-44-34-28(33)14-15-43-34)16-23-4-6-25(7-5-23)47-26-10-8-24(42-3)9-11-26/h4-13,17,22,28-30,33-34,38H,14-16,18-21H2,1-3H3,(H,36,39)/t28-,29-,30+,33-,34+/m0/s1