1-(4-methyl-3-nitro-phenyl)pentan-1-one

Systemtic Name: 1-(4-methyl-3-nitro-phenyl)pentan-1-one Openeye Name: 1-(4-methyl-3-nitro-phenyl)pentan-1-one CAS Name: 1-(4-methyl-3-nitrophenyl)-1-pentanone IUPAC Name: 1-(4-methyl-3-nitrophenyl)pentan-1-one Traditional Name: 1-(4-methyl-3-nitro-phenyl)pentan-1-one Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO3/c1-3-4-5-12(14)10-7-6-9(2)11(8-10)13(15)16/h6-8H,3-5H2,1-2H3