2,4-dimethyl-3-nitro-2-oxidanyl-3-phenyl-cyclopentan-1-one

Systemtic Name: 2,4-dimethyl-3-nitro-2-oxidanyl-3-phenyl-cyclopentan-1-one Openeye Name: 2-hydroxy-2,4-dimethyl-3-nitro-3-phenyl-cyclopentanone CAS Name: 2-hydroxy-2,4-dimethyl-3-nitro-3-phenyl-1-cyclopentanone IUPAC Name: 2-hydroxy-2,4-dimethyl-3-nitro-3-phenylcyclopentan-1-one Traditional Name: 2-hydroxy-2,4-dimethyl-3-nitro-3-phenyl-cyclopentanone Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C(C1(C2=CC=CC=C2)[N+](=O)[O-])(C)O

Isomeric SMILES

CC1CC(=O)C(C1(C2=CC=CC=C2)[N+](=O)[O-])(C)O

InChI

InChI=1S/C13H15NO4/c1-9-8-11(15)12(2,16)13(9,14(17)18)10-6-4-3-5-7-10/h3-7,9,16H,8H2,1-2H3