2-[1-(4-chlorophenyl)hex-2-ynoxy]-3-methyl-butanenitrile oxide

Systemtic Name: 2-[1-(4-chlorophenyl)hex-2-ynoxy]-3-methyl-butanenitrile oxide Openeye Name: 2-[1-(4-chlorophenyl)hex-2-ynoxy]-3-methyl-butanenitrile oxide CAS Name: 2-[1-(4-chlorophenyl)hex-2-ynoxy]-3-methylbutanenitrile oxide IUPAC Name: 2-[1-(4-chlorophenyl)hex-2-ynoxy]-3-methylbutanenitrile oxide Traditional Name: 2-[1-(4-chlorophenyl)hex-2-ynoxy]-3-methyl-butyronitrile oxide Formula: C17H20ClNO2 MolecularWeight: 305.7992

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CC(C1=CC=C(C=C1)Cl)OC(C#[N+][O-])C(C)C

Isomeric SMILES

CCCC#CC(C1=CC=C(C=C1)Cl)OC(C#[N+][O-])C(C)C

InChI

InChI=1S/C17H20ClNO2/c1-4-5-6-7-16(14-8-10-15(18)11-9-14)21-17(12-19-20)13(2)3/h8-11,13,16-17H,4-5H2,1-3H3