2,4-bis(hydroxymethyl)-5-oxidanylidene-2-phenoxy-hexanenitrile

Systemtic Name: 2,4-bis(hydroxymethyl)-5-oxidanylidene-2-phenoxy-hexanenitrile Openeye Name: 2,4-bis(hydroxymethyl)-5-oxo-2-phenoxy-hexanenitrile CAS Name: 2,4-bis(hydroxymethyl)-5-oxo-2-phenoxyhexanenitrile IUPAC Name: 2,4-bis(hydroxymethyl)-5-oxo-2-phenoxyhexanenitrile Traditional Name: 5-keto-2,4-dimethylol-2-phenoxy-hexanenitrile Formula: C14H17NO4 MolecularWeight: 263.28908

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC(CO)(C#N)OC1=CC=CC=C1)CO

Isomeric SMILES

CC(=O)C(CC(CO)(C#N)OC1=CC=CC=C1)CO

InChI

InChI=1S/C14H17NO4/c1-11(18)12(8-16)7-14(9-15,10-17)19-13-5-3-2-4-6-13/h2-6,12,16-17H,7-8,10H2,1H3