(2S)-6-chloranyl-2-[(1R)-1-oxidanylbutyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: (2S)-6-chloranyl-2-[(1R)-1-oxidanylbutyl]-4H-1,4-benzoxazin-3-one Openeye Name: (2S)-6-chloro-2-[(1R)-1-hydroxybutyl]-4H-1,4-benzoxazin-3-one CAS Name: (2S)-6-chloro-2-[(1R)-1-hydroxybutyl]-4H-1,4-benzoxazin-3-one IUPAC Name: (2S)-6-chloro-2-[(1R)-1-hydroxybutyl]-4H-1,4-benzoxazin-3-one Traditional Name: (2S)-6-chloro-2-[(1R)-1-hydroxybutyl]-4H-1,4-benzoxazin-3-one Formula: C12H14ClNO3 MolecularWeight: 255.69746

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1C(=O)NC2=C(O1)C=CC(=C2)Cl)O

Isomeric SMILES

CCC[C@H]([C@H]1C(=O)NC2=C(O1)C=CC(=C2)Cl)O

InChI

InChI=1S/C12H14ClNO3/c1-2-3-9(15)11-12(16)14-8-6-7(13)4-5-10(8)17-11/h4-6,9,11,15H,2-3H2,1H3,(H,14,16)/t9-,11+/m1/s1