4-(3-azanyl-3-methyl-but-1-ynyl)-6-chloranyl-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one

Systemtic Name: 4-(3-azanyl-3-methyl-but-1-ynyl)-6-chloranyl-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one Openeye Name: 4-(3-amino-3-methyl-but-1-ynyl)-6-chloro-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one CAS Name: 4-(3-amino-3-methylbut-1-ynyl)-6-chloro-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one IUPAC Name: 4-(3-amino-3-methylbut-1-ynyl)-6-chloro-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one Traditional Name: 4-(3-amino-3-methyl-but-1-ynyl)-6-chloro-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one Formula: C14H12ClF3N2O2 MolecularWeight: 332.70549

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1(C2=C(C=CC(=C2)Cl)NC(=O)O1)C(F)(F)F)N

Isomeric SMILES

CC(C)(C#CC1(C2=C(C=CC(=C2)Cl)NC(=O)O1)C(F)(F)F)N

InChI

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