[(2S,3R)-4-[2-methylpropyl-(4-nitrophenyl)sulfonyl-amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamic acid

Systemtic Name: [(2S,3R)-4-[2-methylpropyl-(4-nitrophenyl)sulfonyl-amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamic acid Openeye Name: [(1S,2R)-1-benzyl-2-hydroxy-3-[isobutyl-(4-nitrophenyl)sulfonyl-amino]propyl]carbamic acid CAS Name: [(2S,3R)-3-hydroxy-4-[2-methylpropyl-(4-nitrophenyl)sulfonylamino]-1-phenylbutan-2-yl]carbamic acid IUPAC Name: [(2S,3R)-3-hydroxy-4-[2-methylpropyl-(4-nitrophenyl)sulfonylamino]-1-phenylbutan-2-yl]carbamic acid Traditional Name: [(1S,2R)-1-benzyl-2-hydroxy-3-[isobutyl(nosyl)amino]propyl]carbamic acid Formula: C21H27N3O7S MolecularWeight: 465.51998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)O)O)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN(C[C@H]([C@H](CC1=CC=CC=C1)NC(=O)O)O)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H27N3O7S/c1-15(2)13-23(32(30,31)18-10-8-17(9-11-18)24(28)29)14-20(25)19(22-21(26)27)12-16-6-4-3-5-7-16/h3-11,15,19-20,22,25H,12-14H2,1-2H3,(H,26,27)/t19-,20+/m0/s1