tert-butyl N-[3-[2-methylpropyl-(4-nitrophenyl)sulfonyl-amino]-2-oxidanyl-propyl]carbamate

Systemtic Name: tert-butyl N-[3-[2-methylpropyl-(4-nitrophenyl)sulfonyl-amino]-2-oxidanyl-propyl]carbamate Openeye Name: tert-butyl N-[2-hydroxy-3-[isobutyl-(4-nitrophenyl)sulfonyl-amino]propyl]carbamate CAS Name: N-[2-hydroxy-3-[2-methylpropyl-(4-nitrophenyl)sulfonylamino]propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-hydroxy-3-[2-methylpropyl-(4-nitrophenyl)sulfonylamino]propyl]carbamate Traditional Name: N-[2-hydroxy-3-[isobutyl(nosyl)amino]propyl]carbamic acid tert-butyl ester Formula: C18H29N3O7S MolecularWeight: 431.50376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(CNC(=O)OC(C)(C)C)O)S(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN(CC(CNC(=O)OC(C)(C)C)O)S(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C18H29N3O7S/c1-13(2)11-20(12-15(22)10-19-17(23)28-18(3,4)5)29(26,27)16-8-6-14(7-9-16)21(24)25/h6-9,13,15,22H,10-12H2,1-5H3,(H,19,23)