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

Systemtic Name: 3-[6-chloranyl-2-oxidanylidene-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]-N-pyridin-3-yl-propanamide Openeye Name: 3-[6-chloro-2-oxo-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]-N-(3-pyridyl)propanamide CAS Name: 3-[6-chloro-2-oxo-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]-N-(3-pyridinyl)propanamide IUPAC Name: 3-[6-chloro-2-oxo-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]-N-pyridin-3-ylpropanamide Traditional Name: 3-[6-chloro-2-keto-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]-N-(3-pyridyl)propionamide Formula: C17H13ClF3N3O3 MolecularWeight: 399.75163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)NC(=O)CCC2(C3=C(C=CC(=C3)Cl)NC(=O)O2)C(F)(F)F

Isomeric SMILES

C1=CC(=CN=C1)NC(=O)CCC2(C3=C(C=CC(=C3)Cl)NC(=O)O2)C(F)(F)F

InChI

InChI=1S/C17H13ClF3N3O3/c18-10-3-4-13-12(8-10)16(17(19,20)21,27-15(26)24-13)6-5-14(25)23-11-2-1-7-22-9-11/h1-4,7-9H,5-6H2,(H,23,25)(H,24,26)