[6-chloranyl-2-oxidanylidene-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]methyl N-pyridin-3-ylcarbamate

Systemtic Name: [6-chloranyl-2-oxidanylidene-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]methyl N-pyridin-3-ylcarbamate Openeye Name: [6-chloro-2-oxo-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]methyl N-(3-pyridyl)carbamate CAS Name: N-(3-pyridinyl)carbamic acid [6-chloro-2-oxo-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]methyl ester IUPAC Name: [6-chloro-2-oxo-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]methyl N-pyridin-3-ylcarbamate Traditional Name: N-(3-pyridyl)carbamic acid [6-chloro-2-keto-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]methyl ester Formula: C16H11ClF3N3O4 MolecularWeight: 401.72445

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)NC(=O)OCC2(C3=C(C=CC(=C3)Cl)NC(=O)O2)C(F)(F)F

Isomeric SMILES

C1=CC(=CN=C1)NC(=O)OCC2(C3=C(C=CC(=C3)Cl)NC(=O)O2)C(F)(F)F

InChI

InChI=1S/C16H11ClF3N3O4/c17-9-3-4-12-11(6-9)15(16(18,19)20,27-14(25)23-12)8-26-13(24)22-10-2-1-5-21-7-10/h1-7H,8H2,(H,22,24)(H,23,25)