(1E)-1-[1-[(6-chloranylpyridin-3-yl)methyl]imidazolidin-2-ylidene]-1-nitro-pentan-2-one

Systemtic Name: (1E)-1-[1-[(6-chloranylpyridin-3-yl)methyl]imidazolidin-2-ylidene]-1-nitro-pentan-2-one Openeye Name: (1E)-1-[1-[(6-chloro-3-pyridyl)methyl]imidazolidin-2-ylidene]-1-nitro-pentan-2-one CAS Name: (1E)-1-[1-[(6-chloro-3-pyridinyl)methyl]-2-imidazolidinylidene]-1-nitro-2-pentanone IUPAC Name: (1E)-1-[1-[(6-chloropyridin-3-yl)methyl]imidazolidin-2-ylidene]-1-nitropentan-2-one Traditional Name: (1E)-1-[1-[(6-chloro-3-pyridyl)methyl]imidazolidin-2-ylidene]-1-nitro-pentan-2-one Formula: C14H17ClN4O3 MolecularWeight: 324.76278

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(=C1NCCN1CC2=CN=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)/C(=C\1/NCCN1CC2=CN=C(C=C2)Cl)/[N+](=O)[O-]

InChI

InChI=1S/C14H17ClN4O3/c1-2-3-11(20)13(19(21)22)14-16-6-7-18(14)9-10-4-5-12(15)17-8-10/h4-5,8,16H,2-3,6-7,9H2,1H3/b14-13+