(4-nitrophenyl) (2S)-2-[(S)-furan-2-yl-(methoxyamino)methyl]hexanoate

Systemtic Name: (4-nitrophenyl) (2S)-2-[(S)-furan-2-yl-(methoxyamino)methyl]hexanoate Openeye Name: (4-nitrophenyl) (2S)-2-[(S)-2-furyl-(methoxyamino)methyl]hexanoate CAS Name: (2S)-2-[(S)-2-furanyl-(methoxyamino)methyl]hexanoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) (2S)-2-[(S)-furan-2-yl-(methoxyamino)methyl]hexanoate Traditional Name: (2S)-2-[(S)-2-furyl-(methoxyamino)methyl]hexanoic acid (4-nitrophenyl) ester Formula: C18H22N2O6 MolecularWeight: 362.37708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C1=CC=CO1)NOC)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCC[C@@H]([C@@H](C1=CC=CO1)NOC)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H22N2O6/c1-3-4-6-15(17(19-24-2)16-7-5-12-25-16)18(21)26-14-10-8-13(9-11-14)20(22)23/h5,7-12,15,17,19H,3-4,6H2,1-2H3/t15-,17-/m0/s1