3-[(5-nitroso-2-oxidanyl-phenyl)amino]propanenitrile

Systemtic Name: 3-[(5-nitroso-2-oxidanyl-phenyl)amino]propanenitrile Openeye Name: 3-(2-hydroxy-5-nitroso-anilino)propanenitrile CAS Name: 3-(2-hydroxy-5-nitrosoanilino)propanenitrile IUPAC Name: 3-(2-hydroxy-5-nitrosoanilino)propanenitrile Traditional Name: 3-(2-hydroxy-5-nitroso-anilino)propionitrile Formula: C9H9N3O2 MolecularWeight: 191.18666

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N=O)NCCC#N)O

Isomeric SMILES

C1=CC(=C(C=C1N=O)NCCC#N)O

InChI

InChI=1S/C9H9N3O2/c10-4-1-5-11-8-6-7(12-14)2-3-9(8)13/h2-3,6,11,13H,1,5H2