2,4-dimethyl-2-(5-nitro-1,3-benzoxazol-2-yl)pentan-3-one

Systemtic Name: 2,4-dimethyl-2-(5-nitro-1,3-benzoxazol-2-yl)pentan-3-one Openeye Name: 2,4-dimethyl-2-(5-nitro-1,3-benzoxazol-2-yl)pentan-3-one CAS Name: 2,4-dimethyl-2-(5-nitro-1,3-benzoxazol-2-yl)-3-pentanone IUPAC Name: 2,4-dimethyl-2-(5-nitro-1,3-benzoxazol-2-yl)pentan-3-one Traditional Name: 2,4-dimethyl-2-(5-nitro-1,3-benzoxazol-2-yl)pentan-3-one Formula: C14H16N2O4 MolecularWeight: 276.28784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C(C)(C)C1=NC2=C(O1)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(=O)C(C)(C)C1=NC2=C(O1)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H16N2O4/c1-8(2)12(17)14(3,4)13-15-10-7-9(16(18)19)5-6-11(10)20-13/h5-8H,1-4H3