2-(1,3-dioxan-2-yl)-3-methoxy-benzenecarbonitrile oxide

Systemtic Name: 2-(1,3-dioxan-2-yl)-3-methoxy-benzenecarbonitrile oxide Openeye Name: 2-(1,3-dioxan-2-yl)-3-methoxy-benzonitrile oxide CAS Name: 2-(1,3-dioxan-2-yl)-3-methoxybenzonitrile oxide IUPAC Name: 2-(1,3-dioxan-2-yl)-3-methoxybenzonitrile oxide Traditional Name: 2-(1,3-dioxan-2-yl)-3-methoxy-benzonitrile oxide Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1C2OCCCO2)C#[N+][O-]

Isomeric SMILES

COC1=CC=CC(=C1C2OCCCO2)C#[N+][O-]

InChI

InChI=1S/C12H13NO4/c1-15-10-5-2-4-9(8-13-14)11(10)12-16-6-3-7-17-12/h2,4-5,12H,3,6-7H2,1H3