(4S)-6-chloranyl-4-(3-oxidanylprop-1-ynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one

Systemtic Name: (4S)-6-chloranyl-4-(3-oxidanylprop-1-ynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one Openeye Name: (4S)-6-chloro-4-(3-hydroxyprop-1-ynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one CAS Name: (4S)-6-chloro-4-(3-hydroxyprop-1-ynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one IUPAC Name: (4S)-6-chloro-4-(3-hydroxyprop-1-ynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one Traditional Name: (4S)-6-chloro-4-(3-hydroxyprop-1-ynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one Formula: C12H7ClF3NO3 MolecularWeight: 305.63709

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)C(OC(=O)N2)(C#CCO)C(F)(F)F

Isomeric SMILES

C1=CC2=C(C=C1Cl)[C@@](OC(=O)N2)(C#CCO)C(F)(F)F

InChI

InChI=1S/C12H7ClF3NO3/c13-7-2-3-9-8(6-7)11(4-1-5-18,12(14,15)16)20-10(19)17-9/h2-3,6,18H,5H2,(H,17,19)/t11-/m0/s1