2-[(2S)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-oxidanylidene-1,4-benzoxazin-2-yl]ethanoate

Systemtic Name: 2-[(2S)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-oxidanylidene-1,4-benzoxazin-2-yl]ethanoate Openeye Name: 2-[(2S)-4-[(3,5-dimethylisoxazol-4-yl)methyl]-3-oxo-1,4-benzoxazin-2-yl]acetate CAS Name: 2-[(2S)-4-[(3,5-dimethyl-4-isoxazolyl)methyl]-3-oxo-1,4-benzoxazin-2-yl]acetate IUPAC Name: 2-[(2S)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-oxo-1,4-benzoxazin-2-yl]acetate Traditional Name: 2-[(2S)-4-[(3,5-dimethylisoxazol-4-yl)methyl]-3-keto-1,4-benzoxazin-2-yl]acetate Formula: C16H15N2O5- MolecularWeight: 315.3007

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CN2C3=CC=CC=C3OC(C2=O)CC(=O)[O-]

Isomeric SMILES

CC1=C(C(=NO1)C)CN2C3=CC=CC=C3O[C@H](C2=O)CC(=O)[O-]

InChI

InChI=1S/C16H16N2O5/c1-9-11(10(2)23-17-9)8-18-12-5-3-4-6-13(12)22-14(16(18)21)7-15(19)20/h3-6,14H,7-8H2,1-2H3,(H,19,20)/p-1/t14-/m0/s1