2-[(6-chloranyl-5-nitro-pyrimidin-4-yl)-methyl-amino]ethanenitrile

Systemtic Name: 2-[(6-chloranyl-5-nitro-pyrimidin-4-yl)-methyl-amino]ethanenitrile Openeye Name: 2-[(6-chloro-5-nitro-pyrimidin-4-yl)-methyl-amino]acetonitrile CAS Name: 2-[(6-chloro-5-nitro-4-pyrimidinyl)-methylamino]acetonitrile IUPAC Name: 2-[(6-chloro-5-nitropyrimidin-4-yl)-methylamino]acetonitrile Traditional Name: 2-[(6-chloro-5-nitro-pyrimidin-4-yl)-methyl-amino]acetonitrile Formula: C7H6ClN5O2 MolecularWeight: 227.60784

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC#N)C1=C(C(=NC=N1)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(CC#N)C1=C(C(=NC=N1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C7H6ClN5O2/c1-12(3-2-9)7-5(13(14)15)6(8)10-4-11-7/h4H,3H2,1H3