6-(methylamino)-4-(4-methylpent-1-ynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one

Systemtic Name: 6-(methylamino)-4-(4-methylpent-1-ynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one Openeye Name: 6-(methylamino)-4-(4-methylpent-1-ynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one CAS Name: 6-(methylamino)-4-(4-methylpent-1-ynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one IUPAC Name: 6-(methylamino)-4-(4-methylpent-1-ynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one Traditional Name: 6-(methylamino)-4-(4-methylpent-1-ynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one Formula: C16H17F3N2O2 MolecularWeight: 326.31359

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17F3N2O2/c1-10(2)5-4-8-15(16(17,18)19)12-9-11(20-3)6-7-13(12)21-14(22)23-15/h6-7,9-10,20H,5H2,1-3H3,(H,21,22)