3-[(2-chloranyl-5-nitro-phenyl)methylamino]propanenitrile

Systemtic Name: 3-[(2-chloranyl-5-nitro-phenyl)methylamino]propanenitrile Openeye Name: 3-[(2-chloro-5-nitro-phenyl)methylamino]propanenitrile CAS Name: 3-[(2-chloro-5-nitrophenyl)methylamino]propanenitrile IUPAC Name: 3-[(2-chloro-5-nitrophenyl)methylamino]propanenitrile Traditional Name: 3-[(2-chloro-5-nitro-benzyl)amino]propionitrile Formula: C10H10ClN3O2 MolecularWeight: 239.6583

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10ClN3O2/c11-10-3-2-9(14(15)16)6-8(10)7-13-5-1-4-12/h2-3,6,13H,1,5,7H2