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

Systemtic Name: (2R)-2-[(2R)-6-(2-chloranylethanoyl)-3-oxidanylidene-2-propan-2-yl-1,4-benzoxazin-4-yl]propanoate Openeye Name: (2R)-2-[(2R)-6-(2-chloroacetyl)-2-isopropyl-3-oxo-1,4-benzoxazin-4-yl]propanoate CAS Name: (2R)-2-[(2R)-6-(2-chloro-1-oxoethyl)-3-oxo-2-propan-2-yl-1,4-benzoxazin-4-yl]propanoate IUPAC Name: (2R)-2-[(2R)-6-(2-chloroacetyl)-3-oxo-2-propan-2-yl-1,4-benzoxazin-4-yl]propanoate Traditional Name: (2R)-2-[(2R)-6-(2-chloroacetyl)-2-isopropyl-3-keto-1,4-benzoxazin-4-yl]propionate Formula: C16H17ClNO5- MolecularWeight: 338.76288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)CCl)C(C)C(=O)[O-]

Isomeric SMILES

C[C@H](C(=O)[O-])N1C2=C(C=CC(=C2)C(=O)CCl)O[C@@H](C1=O)C(C)C

InChI

InChI=1S/C16H18ClNO5/c1-8(2)14-15(20)18(9(3)16(21)22)11-6-10(12(19)7-17)4-5-13(11)23-14/h4-6,8-9,14H,7H2,1-3H3,(H,21,22)/p-1/t9-,14-/m1/s1