2,4,6-triethyl-3-(hydroxymethyl)benzenecarbonitrile oxide

Systemtic Name: 2,4,6-triethyl-3-(hydroxymethyl)benzenecarbonitrile oxide Openeye Name: 2,4,6-triethyl-3-(hydroxymethyl)benzonitrile oxide CAS Name: 2,4,6-triethyl-3-(hydroxymethyl)benzonitrile oxide IUPAC Name: 2,4,6-triethyl-3-(hydroxymethyl)benzonitrile oxide Traditional Name: 2,4,6-triethyl-3-methylol-benzonitrile oxide Formula: C14H19NO2 MolecularWeight: 233.30616

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C(=C1C#[N+][O-])CC)CO)CC

Isomeric SMILES

CCC1=CC(=C(C(=C1C#[N+][O-])CC)CO)CC

InChI

InChI=1S/C14H19NO2/c1-4-10-7-11(5-2)14(9-16)12(6-3)13(10)8-15-17/h7,16H,4-6,9H2,1-3H3