2-(4-chlorophenyl)-2-pent-2-ynoxy-ethanenitrile oxide

Systemtic Name: 2-(4-chlorophenyl)-2-pent-2-ynoxy-ethanenitrile oxide Openeye Name: 2-(4-chlorophenyl)-2-pent-2-ynoxy-acetonitrile oxide CAS Name: 2-(4-chlorophenyl)-2-pent-2-ynoxyacetonitrile oxide IUPAC Name: 2-(4-chlorophenyl)-2-pent-2-ynoxyacetonitrile oxide Traditional Name: 2-(4-chlorophenyl)-2-pent-2-ynoxy-acetonitrile oxide Formula: C13H12ClNO2 MolecularWeight: 249.69288

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CCOC(C#[N+][O-])C1=CC=C(C=C1)Cl

Isomeric SMILES

CCC#CCOC(C#[N+][O-])C1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H12ClNO2/c1-2-3-4-9-17-13(10-15-16)11-5-7-12(14)8-6-11/h5-8,13H,2,9H2,1H3