1-(3-azanylhex-1-ynyl)-4-(trifluoromethyl)-4H-3,1-benzoxazin-2-one

Systemtic Name: 1-(3-azanylhex-1-ynyl)-4-(trifluoromethyl)-4H-3,1-benzoxazin-2-one Openeye Name: 1-(3-aminohex-1-ynyl)-4-(trifluoromethyl)-4H-3,1-benzoxazin-2-one CAS Name: 1-(3-aminohex-1-ynyl)-4-(trifluoromethyl)-4H-3,1-benzoxazin-2-one IUPAC Name: 1-(3-aminohex-1-ynyl)-4-(trifluoromethyl)-4H-3,1-benzoxazin-2-one Traditional Name: 1-(3-aminohex-1-ynyl)-4-(trifluoromethyl)-4H-3,1-benzoxazin-2-one Formula: C15H15F3N2O2 MolecularWeight: 312.28701

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C#CN1C2=CC=CC=C2C(OC1=O)C(F)(F)F)N

Isomeric SMILES

CCCC(C#CN1C2=CC=CC=C2C(OC1=O)C(F)(F)F)N

InChI

InChI=1S/C15H15F3N2O2/c1-2-5-10(19)8-9-20-12-7-4-3-6-11(12)13(15(16,17)18)22-14(20)21/h3-4,6-7,10,13H,2,5,19H2,1H3