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

Systemtic Name: [(2S,3R)-4-[3-methylbutyl-(4-nitrophenyl)sulfonyl-amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamic acid Openeye Name: [(1S,2R)-1-benzyl-2-hydroxy-3-[isopentyl-(4-nitrophenyl)sulfonyl-amino]propyl]carbamic acid CAS Name: [(2S,3R)-3-hydroxy-4-[3-methylbutyl-(4-nitrophenyl)sulfonylamino]-1-phenylbutan-2-yl]carbamic acid IUPAC Name: [(2S,3R)-3-hydroxy-4-[3-methylbutyl-(4-nitrophenyl)sulfonylamino]-1-phenylbutan-2-yl]carbamic acid Traditional Name: [(1S,2R)-1-benzyl-2-hydroxy-3-[isoamyl(nosyl)amino]propyl]carbamic acid Formula: C22H29N3O7S MolecularWeight: 479.54656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(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)CCN(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/C22H29N3O7S/c1-16(2)12-13-24(33(31,32)19-10-8-18(9-11-19)25(29)30)15-21(26)20(23-22(27)28)14-17-6-4-3-5-7-17/h3-11,16,20-21,23,26H,12-15H2,1-2H3,(H,27,28)/t20-,21+/m0/s1