3-(4-nitrophenyl)-3-oxidanyl-propanenitrile

Systemtic Name: 3-(4-nitrophenyl)-3-oxidanyl-propanenitrile Openeye Name: 3-hydroxy-3-(4-nitrophenyl)propanenitrile CAS Name: 3-hydroxy-3-(4-nitrophenyl)propanenitrile IUPAC Name: 3-hydroxy-3-(4-nitrophenyl)propanenitrile Traditional Name: 3-hydroxy-3-(4-nitrophenyl)propionitrile Formula: C9H8N2O3 MolecularWeight: 192.17142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CC#N)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(CC#N)O)[N+](=O)[O-]

InChI

InChI=1S/C9H8N2O3/c10-6-5-9(12)7-1-3-8(4-2-7)11(13)14/h1-4,9,12H,5H2