(2S)-6-(2-chloranylethanoyl)-2-methyl-4-pentyl-1,4-benzoxazin-3-one

Systemtic Name: (2S)-6-(2-chloranylethanoyl)-2-methyl-4-pentyl-1,4-benzoxazin-3-one Openeye Name: (2S)-6-(2-chloroacetyl)-2-methyl-4-pentyl-1,4-benzoxazin-3-one CAS Name: (2S)-6-(2-chloro-1-oxoethyl)-2-methyl-4-pentyl-1,4-benzoxazin-3-one IUPAC Name: (2S)-6-(2-chloroacetyl)-2-methyl-4-pentyl-1,4-benzoxazin-3-one Traditional Name: (2S)-4-amyl-6-(2-chloroacetyl)-2-methyl-1,4-benzoxazin-3-one Formula: C16H20ClNO3 MolecularWeight: 309.7879

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=C(C=CC(=C2)C(=O)CCl)OC(C1=O)C

Isomeric SMILES

CCCCCN1C2=C(C=CC(=C2)C(=O)CCl)O[C@H](C1=O)C

InChI

InChI=1S/C16H20ClNO3/c1-3-4-5-8-18-13-9-12(14(19)10-17)6-7-15(13)21-11(2)16(18)20/h6-7,9,11H,3-5,8,10H2,1-2H3/t11-/m0/s1