(E)-5-methyl-1-(3-nitrophenyl)hex-1-en-3-one

Systemtic Name: (E)-5-methyl-1-(3-nitrophenyl)hex-1-en-3-one Openeye Name: (E)-5-methyl-1-(3-nitrophenyl)hex-1-en-3-one CAS Name: (E)-5-methyl-1-(3-nitrophenyl)-1-hexen-3-one IUPAC Name: (E)-5-methyl-1-(3-nitrophenyl)hex-1-en-3-one Traditional Name: (E)-5-methyl-1-(3-nitrophenyl)hex-1-en-3-one Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO3/c1-10(2)8-13(15)7-6-11-4-3-5-12(9-11)14(16)17/h3-7,9-10H,8H2,1-2H3/b7-6+