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

Systemtic Name: 2-[(2S)-3-oxidanylidene-2-phenyl-1,4-benzoxazin-4-yl]ethanoate Openeye Name: 2-[(2S)-3-oxo-2-phenyl-1,4-benzoxazin-4-yl]acetate CAS Name: 2-[(2S)-3-oxo-2-phenyl-1,4-benzoxazin-4-yl]acetate IUPAC Name: 2-[(2S)-3-oxo-2-phenyl-1,4-benzoxazin-4-yl]acetate Traditional Name: 2-[(2S)-3-keto-2-phenyl-1,4-benzoxazin-4-yl]acetate Formula: C16H12NO4- MolecularWeight: 282.27078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(=O)N(C3=CC=CC=C3O2)CC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[C@H]2C(=O)N(C3=CC=CC=C3O2)CC(=O)[O-]

InChI

InChI=1S/C16H13NO4/c18-14(19)10-17-12-8-4-5-9-13(12)21-15(16(17)20)11-6-2-1-3-7-11/h1-9,15H,10H2,(H,18,19)/p-1/t15-/m0/s1