2-[(2R)-6-ethanoyl-3-oxidanylidene-2-propan-2-yl-1,4-benzoxazin-4-yl]ethanenitrile

Systemtic Name: 2-[(2R)-6-ethanoyl-3-oxidanylidene-2-propan-2-yl-1,4-benzoxazin-4-yl]ethanenitrile Openeye Name: 2-[(2R)-6-acetyl-2-isopropyl-3-oxo-1,4-benzoxazin-4-yl]acetonitrile CAS Name: 2-[(2R)-6-acetyl-3-oxo-2-propan-2-yl-1,4-benzoxazin-4-yl]acetonitrile IUPAC Name: 2-[(2R)-6-acetyl-3-oxo-2-propan-2-yl-1,4-benzoxazin-4-yl]acetonitrile Traditional Name: 2-[(2R)-6-acetyl-2-isopropyl-3-keto-1,4-benzoxazin-4-yl]acetonitrile Formula: C15H16N2O3 MolecularWeight: 272.29914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)C)CC#N

Isomeric SMILES

CC(C)[C@@H]1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)C)CC#N

InChI

InChI=1S/C15H16N2O3/c1-9(2)14-15(19)17(7-6-16)12-8-11(10(3)18)4-5-13(12)20-14/h4-5,8-9,14H,7H2,1-3H3/t14-/m1/s1