4-[(2-chloranyl-6-methyl-3-nitro-pyridin-4-yl)-ethyl-amino]butanenitrile

Systemtic Name: 4-[(2-chloranyl-6-methyl-3-nitro-pyridin-4-yl)-ethyl-amino]butanenitrile Openeye Name: 4-[(2-chloro-6-methyl-3-nitro-4-pyridyl)-ethyl-amino]butanenitrile CAS Name: 4-[(2-chloro-6-methyl-3-nitro-4-pyridinyl)-ethylamino]butanenitrile IUPAC Name: 4-[(2-chloro-6-methyl-3-nitropyridin-4-yl)-ethylamino]butanenitrile Traditional Name: 4-[(2-chloro-6-methyl-3-nitro-4-pyridyl)-ethyl-amino]butyronitrile Formula: C12H15ClN4O2 MolecularWeight: 282.7261

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCC#N)C1=CC(=NC(=C1[N+](=O)[O-])Cl)C

Isomeric SMILES

CCN(CCCC#N)C1=CC(=NC(=C1[N+](=O)[O-])Cl)C

InChI

InChI=1S/C12H15ClN4O2/c1-3-16(7-5-4-6-14)10-8-9(2)15-12(13)11(10)17(18)19/h8H,3-5,7H2,1-2H3