(2R)-2-(6-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate

Systemtic Name: (2R)-2-(6-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate Openeye Name: (2R)-2-(6-methyl-3-oxo-1,4-benzoxazin-4-yl)propanoate CAS Name: (2R)-2-(6-methyl-3-oxo-1,4-benzoxazin-4-yl)propanoate IUPAC Name: (2R)-2-(6-methyl-3-oxo-1,4-benzoxazin-4-yl)propanoate Traditional Name: (2R)-2-(3-keto-6-methyl-1,4-benzoxazin-4-yl)propionate Formula: C12H12NO4- MolecularWeight: 234.22798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCC(=O)N2C(C)C(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)OCC(=O)N2[C@H](C)C(=O)[O-]

InChI

InChI=1S/C12H13NO4/c1-7-3-4-10-9(5-7)13(8(2)12(15)16)11(14)6-17-10/h3-5,8H,6H2,1-2H3,(H,15,16)/p-1/t8-/m1/s1