ethyl (4S)-3-nitro-2-oxidanyl-4-phenylmethoxy-pentanoate

Systemtic Name: ethyl (4S)-3-nitro-2-oxidanyl-4-phenylmethoxy-pentanoate Openeye Name: ethyl (4S)-4-benzyloxy-2-hydroxy-3-nitro-pentanoate CAS Name: (4S)-2-hydroxy-3-nitro-4-phenylmethoxypentanoic acid ethyl ester IUPAC Name: ethyl (4S)-2-hydroxy-3-nitro-4-phenylmethoxypentanoate Traditional Name: (4S)-4-benzoxy-2-hydroxy-3-nitro-valeric acid ethyl ester Formula: C14H19NO6 MolecularWeight: 297.30376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C(C)OCC1=CC=CC=C1)[N+](=O)[O-])O

Isomeric SMILES

CCOC(=O)C(C([C@H](C)OCC1=CC=CC=C1)[N+](=O)[O-])O

InChI

InChI=1S/C14H19NO6/c1-3-20-14(17)13(16)12(15(18)19)10(2)21-9-11-7-5-4-6-8-11/h4-8,10,12-13,16H,3,9H2,1-2H3/t10-,12?,13?/m0/s1