2,2-dimethyl-3-[(2R)-3-oxidanylidene-2-propan-2-yl-1,4-benzoxazin-4-yl]propanoate

Systemtic Name: 2,2-dimethyl-3-[(2R)-3-oxidanylidene-2-propan-2-yl-1,4-benzoxazin-4-yl]propanoate Openeye Name: 3-[(2R)-2-isopropyl-3-oxo-1,4-benzoxazin-4-yl]-2,2-dimethyl-propanoate CAS Name: 2,2-dimethyl-3-[(2R)-3-oxo-2-propan-2-yl-1,4-benzoxazin-4-yl]propanoate IUPAC Name: 2,2-dimethyl-3-[(2R)-3-oxo-2-propan-2-yl-1,4-benzoxazin-4-yl]propanoate Traditional Name: 3-[(2R)-2-isopropyl-3-keto-1,4-benzoxazin-4-yl]-2,2-dimethyl-propionate Formula: C16H20NO4- MolecularWeight: 290.3343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)N(C2=CC=CC=C2O1)CC(C)(C)C(=O)[O-]

Isomeric SMILES

CC(C)[C@@H]1C(=O)N(C2=CC=CC=C2O1)CC(C)(C)C(=O)[O-]

InChI

InChI=1S/C16H21NO4/c1-10(2)13-14(18)17(9-16(3,4)15(19)20)11-7-5-6-8-12(11)21-13/h5-8,10,13H,9H2,1-4H3,(H,19,20)/p-1/t13-/m1/s1