N-butyl-2-[(2S)-6-(2-chloranylethanoyl)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanamide

Systemtic Name: N-butyl-2-[(2S)-6-(2-chloranylethanoyl)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanamide Openeye Name: N-butyl-2-[(2S)-6-(2-chloroacetyl)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]acetamide CAS Name: N-butyl-2-[(2S)-6-(2-chloro-1-oxoethyl)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]acetamide IUPAC Name: N-butyl-2-[(2S)-6-(2-chloroacetyl)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]acetamide Traditional Name: N-butyl-2-[(2S)-6-(2-chloroacetyl)-3-keto-2-methyl-1,4-benzoxazin-4-yl]acetamide Formula: C17H21ClN2O4 MolecularWeight: 352.81264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1C2=C(C=CC(=C2)C(=O)CCl)OC(C1=O)C

Isomeric SMILES

CCCCNC(=O)CN1C2=C(C=CC(=C2)C(=O)CCl)O[C@H](C1=O)C

InChI

InChI=1S/C17H21ClN2O4/c1-3-4-7-19-16(22)10-20-13-8-12(14(21)9-18)5-6-15(13)24-11(2)17(20)23/h5-6,8,11H,3-4,7,9-10H2,1-2H3,(H,19,22)/t11-/m0/s1