2-methyl-6-(4-nitrophenyl)hexan-3-one

Systemtic Name: 2-methyl-6-(4-nitrophenyl)hexan-3-one Openeye Name: 2-methyl-6-(4-nitrophenyl)hexan-3-one CAS Name: 2-methyl-6-(4-nitrophenyl)-3-hexanone IUPAC Name: 2-methyl-6-(4-nitrophenyl)hexan-3-one Traditional Name: 2-methyl-6-(4-nitrophenyl)hexan-3-one Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)CCCC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(=O)CCCC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H17NO3/c1-10(2)13(15)5-3-4-11-6-8-12(9-7-11)14(16)17/h6-10H,3-5H2,1-2H3