ethyl N-[(1S,2S)-3-methoxy-1-(4-nitrophenyl)-1-oxidanyl-propan-2-yl]carbamate

Systemtic Name: ethyl N-[(1S,2S)-3-methoxy-1-(4-nitrophenyl)-1-oxidanyl-propan-2-yl]carbamate Openeye Name: ethyl N-[(1S,2S)-2-hydroxy-1-(methoxymethyl)-2-(4-nitrophenyl)ethyl]carbamate CAS Name: N-[(1S,2S)-1-hydroxy-3-methoxy-1-(4-nitrophenyl)propan-2-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[(1S,2S)-1-hydroxy-3-methoxy-1-(4-nitrophenyl)propan-2-yl]carbamate Traditional Name: N-[(1S,2S)-2-hydroxy-1-(methoxymethyl)-2-(4-nitrophenyl)ethyl]carbamic acid ethyl ester Formula: C13H18N2O6 MolecularWeight: 298.29182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(COC)C(C1=CC=C(C=C1)[N+](=O)[O-])O

Isomeric SMILES

CCOC(=O)N[C@@H](COC)[C@H](C1=CC=C(C=C1)[N+](=O)[O-])O

InChI

InChI=1S/C13H18N2O6/c1-3-21-13(17)14-11(8-20-2)12(16)9-4-6-10(7-5-9)15(18)19/h4-7,11-12,16H,3,8H2,1-2H3,(H,14,17)/t11-,12-/m0/s1