N-(7-nitro-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-2-[3-(trifluoromethyl)piperidin-1-yl]ethanamide

Systemtic Name: N-(7-nitro-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-2-[3-(trifluoromethyl)piperidin-1-yl]ethanamide Openeye Name: N-(7-nitro-3-oxo-4H-1,4-benzoxazin-6-yl)-2-[3-(trifluoromethyl)-1-piperidyl]acetamide CAS Name: N-(7-nitro-3-oxo-4H-1,4-benzoxazin-6-yl)-2-[3-(trifluoromethyl)-1-piperidinyl]acetamide IUPAC Name: N-(7-nitro-3-oxo-4H-1,4-benzoxazin-6-yl)-2-[3-(trifluoromethyl)piperidin-1-yl]acetamide Traditional Name: N-(3-keto-7-nitro-4H-1,4-benzoxazin-6-yl)-2-[3-(trifluoromethyl)piperidino]acetamide Formula: C16H17F3N4O5 MolecularWeight: 402.32519

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC(=O)NC2=C(C=C3C(=C2)NC(=O)CO3)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1CC(CN(C1)CC(=O)NC2=C(C=C3C(=C2)NC(=O)CO3)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C16H17F3N4O5/c17-16(18,19)9-2-1-3-22(6-9)7-14(24)20-10-4-11-13(5-12(10)23(26)27)28-8-15(25)21-11/h4-5,9H,1-3,6-8H2,(H,20,24)(H,21,25)