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

Systemtic Name: 2-[(2S)-6-(2-chloranylethanoyl)-3-oxidanylidene-2-phenyl-1,4-benzoxazin-4-yl]ethanoate Openeye Name: 2-[(2S)-6-(2-chloroacetyl)-3-oxo-2-phenyl-1,4-benzoxazin-4-yl]acetate CAS Name: 2-[(2S)-6-(2-chloro-1-oxoethyl)-3-oxo-2-phenyl-1,4-benzoxazin-4-yl]acetate IUPAC Name: 2-[(2S)-6-(2-chloroacetyl)-3-oxo-2-phenyl-1,4-benzoxazin-4-yl]acetate Traditional Name: 2-[(2S)-6-(2-chloroacetyl)-3-keto-2-phenyl-1,4-benzoxazin-4-yl]acetate Formula: C18H13ClNO5- MolecularWeight: 358.75252

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(=O)N(C3=C(O2)C=CC(=C3)C(=O)CCl)CC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[C@H]2C(=O)N(C3=C(O2)C=CC(=C3)C(=O)CCl)CC(=O)[O-]

InChI

InChI=1S/C18H14ClNO5/c19-9-14(21)12-6-7-15-13(8-12)20(10-16(22)23)18(24)17(25-15)11-4-2-1-3-5-11/h1-8,17H,9-10H2,(H,22,23)/p-1/t17-/m0/s1