3,5-bis(hydroxymethyl)-4-oxidanyl-benzenecarbonitrile

Systemtic Name: 3,5-bis(hydroxymethyl)-4-oxidanyl-benzenecarbonitrile Openeye Name: 4-hydroxy-3,5-bis(hydroxymethyl)benzonitrile CAS Name: 4-hydroxy-3,5-bis(hydroxymethyl)benzonitrile IUPAC Name: 4-hydroxy-3,5-bis(hydroxymethyl)benzonitrile Traditional Name: 4-hydroxy-3,5-dimethylol-benzonitrile Formula: C9H9NO3 MolecularWeight: 179.17266

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1CO)O)CO)C#N

Isomeric SMILES

C1=C(C=C(C(=C1CO)O)CO)C#N

InChI

InChI=1S/C9H9NO3/c10-3-6-1-7(4-11)9(13)8(2-6)5-12/h1-2,11-13H,4-5H2