3-[(6-chloranyl-5-nitro-pyrimidin-4-yl)-(2-cyanoethyl)amino]propanenitrile

Systemtic Name: 3-[(6-chloranyl-5-nitro-pyrimidin-4-yl)-(2-cyanoethyl)amino]propanenitrile Openeye Name: 3-[(6-chloro-5-nitro-pyrimidin-4-yl)-(2-cyanoethyl)amino]propanenitrile CAS Name: 3-[(6-chloro-5-nitro-4-pyrimidinyl)-(2-cyanoethyl)amino]propanenitrile IUPAC Name: 3-[(6-chloro-5-nitropyrimidin-4-yl)-(2-cyanoethyl)amino]propanenitrile Traditional Name: 3-[(6-chloro-5-nitro-pyrimidin-4-yl)-(2-cyanoethyl)amino]propionitrile Formula: C10H9ClN6O2 MolecularWeight: 280.67046

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9ClN6O2/c11-9-8(17(18)19)10(15-7-14-9)16(5-1-3-12)6-2-4-13/h7H,1-2,5-6H2