1-chloranyl-4-[3-(dimethylamino)prop-1-ynyl]-4-(trifluoromethyl)-3,1-benzoxazin-2-one

Systemtic Name: 1-chloranyl-4-[3-(dimethylamino)prop-1-ynyl]-4-(trifluoromethyl)-3,1-benzoxazin-2-one Openeye Name: 1-chloro-4-[3-(dimethylamino)prop-1-ynyl]-4-(trifluoromethyl)-3,1-benzoxazin-2-one CAS Name: 1-chloro-4-[3-(dimethylamino)prop-1-ynyl]-4-(trifluoromethyl)-3,1-benzoxazin-2-one IUPAC Name: 1-chloro-4-[3-(dimethylamino)prop-1-ynyl]-4-(trifluoromethyl)-3,1-benzoxazin-2-one Traditional Name: 1-chloro-4-[3-(dimethylamino)prop-1-ynyl]-4-(trifluoromethyl)-3,1-benzoxazin-2-one Formula: C14H12ClF3N2O2 MolecularWeight: 332.70549

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC#CC1(C2=CC=CC=C2N(C(=O)O1)Cl)C(F)(F)F

Isomeric SMILES

CN(C)CC#CC1(C2=CC=CC=C2N(C(=O)O1)Cl)C(F)(F)F

InChI

InChI=1S/C14H12ClF3N2O2/c1-19(2)9-5-8-13(14(16,17)18)10-6-3-4-7-11(10)20(15)12(21)22-13/h3-4,6-7H,9H2,1-2H3