2-[(2S)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-7-methyl-3-oxidanylidene-1,4-benzoxazin-2-yl]ethanoate

Systemtic Name: 2-[(2S)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-7-methyl-3-oxidanylidene-1,4-benzoxazin-2-yl]ethanoate Openeye Name: 2-[(2S)-4-[(3,5-dimethylisoxazol-4-yl)methyl]-7-methyl-3-oxo-1,4-benzoxazin-2-yl]acetate CAS Name: 2-[(2S)-4-[(3,5-dimethyl-4-isoxazolyl)methyl]-7-methyl-3-oxo-1,4-benzoxazin-2-yl]acetate IUPAC Name: 2-[(2S)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-7-methyl-3-oxo-1,4-benzoxazin-2-yl]acetate Traditional Name: 2-[(2S)-4-[(3,5-dimethylisoxazol-4-yl)methyl]-3-keto-7-methyl-1,4-benzoxazin-2-yl]acetate Formula: C17H17N2O5- MolecularWeight: 329.32728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C(O2)CC(=O)[O-])CC3=C(ON=C3C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)[C@@H](O2)CC(=O)[O-])CC3=C(ON=C3C)C

InChI

InChI=1S/C17H18N2O5/c1-9-4-5-13-14(6-9)23-15(7-16(20)21)17(22)19(13)8-12-10(2)18-24-11(12)3/h4-6,15H,7-8H2,1-3H3,(H,20,21)/p-1/t15-/m0/s1