6-[(2S)-2-(2-bromanyl-4-chloranyl-phenoxy)propanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[(2S)-2-(2-bromanyl-4-chloranyl-phenoxy)propanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[(2S)-2-(2-bromo-4-chloro-phenoxy)propanoyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[(2S)-2-(2-bromo-4-chlorophenoxy)-1-oxopropyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[(2S)-2-(2-bromo-4-chlorophenoxy)propanoyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[(2S)-2-(2-bromo-4-chloro-phenoxy)propanoyl]-4H-1,4-benzoxazin-3-one Formula: C17H13BrClNO4 MolecularWeight: 410.64642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC2=C(C=C1)OCC(=O)N2)OC3=C(C=C(C=C3)Cl)Br

Isomeric SMILES

C[C@@H](C(=O)C1=CC2=C(C=C1)OCC(=O)N2)OC3=C(C=C(C=C3)Cl)Br

InChI

InChI=1S/C17H13BrClNO4/c1-9(24-14-5-3-11(19)7-12(14)18)17(22)10-2-4-15-13(6-10)20-16(21)8-23-15/h2-7,9H,8H2,1H3,(H,20,21)/t9-/m0/s1