benzenecarbonitrile; hexadecane; 1,1,1-tris(chloranyl)ethane

Systemtic Name: benzenecarbonitrile; hexadecane; 1,1,1-tris(chloranyl)ethane Openeye Name: benzonitrile; hexadecane; 1,1,1-trichloroethane CAS Name: benzonitrile; hexadecane; 1,1,1-trichloroethane IUPAC Name: benzonitrile; hexadecane; 1,1,1-trichloroethane Traditional Name: benzonitrile; hexadecane; 1,1,1-trichloroethane Formula: C25H42Cl3N MolecularWeight: 462.96668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC.CC(Cl)(Cl)Cl.C1=CC=C(C=C1)C#N

Isomeric SMILES

CCCCCCCCCCCCCCCC.CC(Cl)(Cl)Cl.C1=CC=C(C=C1)C#N

InChI

InChI=1S/C16H34.C7H5N.C2H3Cl3/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2;8-6-7-4-2-1-3-5-7;1-2(3,4)5/h3-16H2,1-2H3;1-5H;1H3