1-(2-methoxy-5-nitro-phenyl)-4,4-dimethyl-pentan-3-one

Systemtic Name: 1-(2-methoxy-5-nitro-phenyl)-4,4-dimethyl-pentan-3-one Openeye Name: 1-(2-methoxy-5-nitro-phenyl)-4,4-dimethyl-pentan-3-one CAS Name: 1-(2-methoxy-5-nitrophenyl)-4,4-dimethyl-3-pentanone IUPAC Name: 1-(2-methoxy-5-nitrophenyl)-4,4-dimethylpentan-3-one Traditional Name: 1-(2-methoxy-5-nitro-phenyl)-4,4-dimethyl-pentan-3-one Formula: C14H19NO4 MolecularWeight: 265.30496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CCC1=C(C=CC(=C1)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)(C)C(=O)CCC1=C(C=CC(=C1)[N+](=O)[O-])OC

InChI

InChI=1S/C14H19NO4/c1-14(2,3)13(16)8-5-10-9-11(15(17)18)6-7-12(10)19-4/h6-7,9H,5,8H2,1-4H3