(2S)-2-(5-fluoranyl-2-nitro-phenoxy)-N-(1,3,5-trimethylpyrazol-4-yl)propanamide

Systemtic Name: (2S)-2-(5-fluoranyl-2-nitro-phenoxy)-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Openeye Name: (2S)-2-(5-fluoro-2-nitro-phenoxy)-N-(1,3,5-trimethylpyrazol-4-yl)propanamide CAS Name: (2S)-2-(5-fluoro-2-nitrophenoxy)-N-(1,3,5-trimethyl-4-pyrazolyl)propanamide IUPAC Name: (2S)-2-(5-fluoro-2-nitrophenoxy)-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Traditional Name: (2S)-2-(5-fluoro-2-nitro-phenoxy)-N-(1,3,5-trimethylpyrazol-4-yl)propionamide Formula: C15H17FN4O4 MolecularWeight: 336.318283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)C(C)OC2=C(C=CC(=C2)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)[C@H](C)OC2=C(C=CC(=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C15H17FN4O4/c1-8-14(9(2)19(4)18-8)17-15(21)10(3)24-13-7-11(16)5-6-12(13)20(22)23/h5-7,10H,1-4H3,(H,17,21)/t10-/m0/s1