2-(2-nitrohept-1-en-3-yl)cyclohexan-1-one

Systemtic Name: 2-(2-nitrohept-1-en-3-yl)cyclohexan-1-one Openeye Name: 2-[1-(1-nitrovinyl)pentyl]cyclohexanone CAS Name: 2-(2-nitrohept-1-en-3-yl)-1-cyclohexanone IUPAC Name: 2-(2-nitrohept-1-en-3-yl)cyclohexan-1-one Traditional Name: 2-(1-butyl-2-nitro-allyl)cyclohexanone Formula: C13H21NO3 MolecularWeight: 239.31074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1CCCCC1=O)C(=C)[N+](=O)[O-]

Isomeric SMILES

CCCCC(C1CCCCC1=O)C(=C)[N+](=O)[O-]

InChI

InChI=1S/C13H21NO3/c1-3-4-7-11(10(2)14(16)17)12-8-5-6-9-13(12)15/h11-12H,2-9H2,1H3