2-[4-chloranyl-6-(4-methoxyphenyl)-5-nitro-pyrimidin-2-yl]cyclopentan-1-one

Systemtic Name: 2-[4-chloranyl-6-(4-methoxyphenyl)-5-nitro-pyrimidin-2-yl]cyclopentan-1-one Openeye Name: 2-[4-chloro-6-(4-methoxyphenyl)-5-nitro-pyrimidin-2-yl]cyclopentanone CAS Name: 2-[4-chloro-6-(4-methoxyphenyl)-5-nitro-2-pyrimidinyl]-1-cyclopentanone IUPAC Name: 2-[4-chloro-6-(4-methoxyphenyl)-5-nitropyrimidin-2-yl]cyclopentan-1-one Traditional Name: 2-[4-chloro-6-(4-methoxyphenyl)-5-nitro-pyrimidin-2-yl]cyclopentanone Formula: C16H14ClN3O4 MolecularWeight: 347.75306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=NC(=N2)C3CCCC3=O)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=NC(=N2)C3CCCC3=O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClN3O4/c1-24-10-7-5-9(6-8-10)13-14(20(22)23)15(17)19-16(18-13)11-3-2-4-12(11)21/h5-8,11H,2-4H2,1H3