2-hexyl-3-(nitromethyl)cyclopentan-1-one

Systemtic Name: 2-hexyl-3-(nitromethyl)cyclopentan-1-one Openeye Name: 2-hexyl-3-(nitromethyl)cyclopentanone CAS Name: 2-hexyl-3-(nitromethyl)-1-cyclopentanone IUPAC Name: 2-hexyl-3-(nitromethyl)cyclopentan-1-one Traditional Name: 2-hexyl-3-(nitromethyl)cyclopentanone Formula: C12H21NO3 MolecularWeight: 227.30004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(CCC1=O)C[N+](=O)[O-]

Isomeric SMILES

CCCCCCC1C(CCC1=O)C[N+](=O)[O-]

InChI

InChI=1S/C12H21NO3/c1-2-3-4-5-6-11-10(9-13(15)16)7-8-12(11)14/h10-11H,2-9H2,1H3