(3-phenyl-1,2-oxazol-5-yl)methyl 3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate

Systemtic Name: (3-phenyl-1,2-oxazol-5-yl)methyl 3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate Openeye Name: (3-phenylisoxazol-5-yl)methyl 3-(3-oxo-1,4-benzoxazin-4-yl)propanoate CAS Name: 3-(3-oxo-1,4-benzoxazin-4-yl)propanoic acid (3-phenyl-5-isoxazolyl)methyl ester IUPAC Name: (3-phenyl-1,2-oxazol-5-yl)methyl 3-(3-oxo-1,4-benzoxazin-4-yl)propanoate Traditional Name: 3-(3-keto-1,4-benzoxazin-4-yl)propionic acid (3-phenylisoxazol-5-yl)methyl ester Formula: C21H18N2O5 MolecularWeight: 378.37802

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=CC=CC=C2O1)CCC(=O)OCC3=CC(=NO3)C4=CC=CC=C4

Isomeric SMILES

C1C(=O)N(C2=CC=CC=C2O1)CCC(=O)OCC3=CC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C21H18N2O5/c24-20-14-26-19-9-5-4-8-18(19)23(20)11-10-21(25)27-13-16-12-17(22-28-16)15-6-2-1-3-7-15/h1-9,12H,10-11,13-14H2