propyl (2S)-2-[6-(2-chloranylethanoyl)-3-oxidanylidene-1,4-benzoxazin-4-yl]propanoate

Systemtic Name: propyl (2S)-2-[6-(2-chloranylethanoyl)-3-oxidanylidene-1,4-benzoxazin-4-yl]propanoate Openeye Name: propyl (2S)-2-[6-(2-chloroacetyl)-3-oxo-1,4-benzoxazin-4-yl]propanoate CAS Name: (2S)-2-[6-(2-chloro-1-oxoethyl)-3-oxo-1,4-benzoxazin-4-yl]propanoic acid propyl ester IUPAC Name: propyl (2S)-2-[6-(2-chloroacetyl)-3-oxo-1,4-benzoxazin-4-yl]propanoate Traditional Name: (2S)-2-[6-(2-chloroacetyl)-3-keto-1,4-benzoxazin-4-yl]propionic acid propyl ester Formula: C16H18ClNO5 MolecularWeight: 339.77082

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(C)N1C(=O)COC2=C1C=C(C=C2)C(=O)CCl

Isomeric SMILES

CCCOC(=O)[C@H](C)N1C(=O)COC2=C1C=C(C=C2)C(=O)CCl

InChI

InChI=1S/C16H18ClNO5/c1-3-6-22-16(21)10(2)18-12-7-11(13(19)8-17)4-5-14(12)23-9-15(18)20/h4-5,7,10H,3,6,8-9H2,1-2H3/t10-/m0/s1