(2R,3R)-7-nitro-3-oxidanyl-2-propyl-3,5-dihydro-2H-1,5-benzoxazepin-4-one

Systemtic Name: (2R,3R)-7-nitro-3-oxidanyl-2-propyl-3,5-dihydro-2H-1,5-benzoxazepin-4-one Openeye Name: (2R,3R)-3-hydroxy-7-nitro-2-propyl-3,5-dihydro-2H-1,5-benzoxazepin-4-one CAS Name: (2R,3R)-3-hydroxy-7-nitro-2-propyl-3,5-dihydro-2H-1,5-benzoxazepin-4-one IUPAC Name: (2R,3R)-3-hydroxy-7-nitro-2-propyl-3,5-dihydro-2H-1,5-benzoxazepin-4-one Traditional Name: (2R,3R)-3-hydroxy-7-nitro-2-propyl-3,5-dihydro-2H-1,5-benzoxazepin-4-one Formula: C12H14N2O5 MolecularWeight: 266.24996

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(C(=O)NC2=C(O1)C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

CCC[C@@H]1[C@H](C(=O)NC2=C(O1)C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C12H14N2O5/c1-2-3-10-11(15)12(16)13-8-6-7(14(17)18)4-5-9(8)19-10/h4-6,10-11,15H,2-3H2,1H3,(H,13,16)/t10-,11-/m1/s1