3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-(5-methyl-2-oxidanyl-phenyl)propan-1-one

Systemtic Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-(5-methyl-2-oxidanyl-phenyl)propan-1-one Openeye Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-(2-hydroxy-5-methyl-phenyl)propan-1-one CAS Name: 3-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-(2-hydroxy-5-methylphenyl)-1-propanone IUPAC Name: 3-(3,5-dimethyl-4-nitropyrazol-1-yl)-1-(2-hydroxy-5-methylphenyl)propan-1-one Traditional Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-(2-hydroxy-5-methyl-phenyl)propan-1-one Formula: C15H17N3O4 MolecularWeight: 303.31318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C(=O)CCN2C(=C(C(=N2)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)O)C(=O)CCN2C(=C(C(=N2)C)[N+](=O)[O-])C

InChI

InChI=1S/C15H17N3O4/c1-9-4-5-13(19)12(8-9)14(20)6-7-17-11(3)15(18(21)22)10(2)16-17/h4-5,8,19H,6-7H2,1-3H3