tert-butyl N-[(2S,3R,4S)-5,5-dimethoxy-4-nitro-3-oxidanyl-1-phenyl-pentan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S,3R,4S)-5,5-dimethoxy-4-nitro-3-oxidanyl-1-phenyl-pentan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S,2R,3S)-1-benzyl-2-hydroxy-4,4-dimethoxy-3-nitro-butyl]carbamate CAS Name: N-[(2S,3R,4S)-3-hydroxy-5,5-dimethoxy-4-nitro-1-phenylpentan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,3R,4S)-3-hydroxy-5,5-dimethoxy-4-nitro-1-phenylpentan-2-yl]carbamate Traditional Name: N-[(1S,2R,3S)-1-benzyl-2-hydroxy-4,4-dimethoxy-3-nitro-butyl]carbamic acid tert-butyl ester Formula: C18H28N2O7 MolecularWeight: 384.42412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(C(C(OC)OC)[N+](=O)[O-])O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)[C@H]([C@@H](C(OC)OC)[N+](=O)[O-])O

InChI

InChI=1S/C18H28N2O7/c1-18(2,3)27-17(22)19-13(11-12-9-7-6-8-10-12)15(21)14(20(23)24)16(25-4)26-5/h6-10,13-16,21H,11H2,1-5H3,(H,19,22)/t13-,14-,15+/m0/s1