tert-butyl N-[(2S,3R)-4-[2-methylpropyl(nitroso)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S,3R)-4-[2-methylpropyl(nitroso)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S,2R)-1-benzyl-2-hydroxy-3-[isobutyl(nitroso)amino]propyl]carbamate CAS Name: N-[(2S,3R)-3-hydroxy-4-[2-methylpropyl(nitroso)amino]-1-phenylbutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,3R)-3-hydroxy-4-[2-methylpropyl(nitroso)amino]-1-phenylbutan-2-yl]carbamate Traditional Name: N-[(1S,2R)-1-benzyl-2-hydroxy-3-[isobutyl(nitroso)amino]propyl]carbamic acid tert-butyl ester Formula: C19H31N3O4 MolecularWeight: 365.46714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)OC(C)(C)C)O)N=O

Isomeric SMILES

CC(C)CN(C[C@H]([C@H](CC1=CC=CC=C1)NC(=O)OC(C)(C)C)O)N=O

InChI

InChI=1S/C19H31N3O4/c1-14(2)12-22(21-25)13-17(23)16(11-15-9-7-6-8-10-15)20-18(24)26-19(3,4)5/h6-10,14,16-17,23H,11-13H2,1-5H3,(H,20,24)/t16-,17+/m0/s1