6-[(2S)-2-chloranylpropanoyl]-4-hexyl-1,4-benzoxazin-3-one

Systemtic Name: 6-[(2S)-2-chloranylpropanoyl]-4-hexyl-1,4-benzoxazin-3-one Openeye Name: 6-[(2S)-2-chloropropanoyl]-4-hexyl-1,4-benzoxazin-3-one CAS Name: 6-[(2S)-2-chloro-1-oxopropyl]-4-hexyl-1,4-benzoxazin-3-one IUPAC Name: 6-[(2S)-2-chloropropanoyl]-4-hexyl-1,4-benzoxazin-3-one Traditional Name: 6-[(2S)-2-chloropropanoyl]-4-hexyl-1,4-benzoxazin-3-one Formula: C17H22ClNO3 MolecularWeight: 323.81448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)COC2=C1C=C(C=C2)C(=O)C(C)Cl

Isomeric SMILES

CCCCCCN1C(=O)COC2=C1C=C(C=C2)C(=O)[C@H](C)Cl

InChI

InChI=1S/C17H22ClNO3/c1-3-4-5-6-9-19-14-10-13(17(21)12(2)18)7-8-15(14)22-11-16(19)20/h7-8,10,12H,3-6,9,11H2,1-2H3/t12-/m0/s1