2-[(4-chloranyl-3-nitro-phenyl)methyl-(cyanomethyl)amino]ethanenitrile

Systemtic Name: 2-[(4-chloranyl-3-nitro-phenyl)methyl-(cyanomethyl)amino]ethanenitrile Openeye Name: 2-[(4-chloro-3-nitro-phenyl)methyl-(cyanomethyl)amino]acetonitrile CAS Name: 2-[(4-chloro-3-nitrophenyl)methyl-(cyanomethyl)amino]acetonitrile IUPAC Name: 2-[(4-chloro-3-nitrophenyl)methyl-(cyanomethyl)amino]acetonitrile Traditional Name: 2-[(4-chloro-3-nitro-benzyl)-(cyanomethyl)amino]acetonitrile Formula: C11H9ClN4O2 MolecularWeight: 264.66776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CN(CC#N)CC#N)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1CN(CC#N)CC#N)[N+](=O)[O-])Cl

InChI

InChI=1S/C11H9ClN4O2/c12-10-2-1-9(7-11(10)16(17)18)8-15(5-3-13)6-4-14/h1-2,7H,5-6,8H2