benzenecarbonitrile; octadecane; 1,1,1,2-tetrakis(chloranyl)ethane

Systemtic Name: benzenecarbonitrile; octadecane; 1,1,1,2-tetrakis(chloranyl)ethane Openeye Name: benzonitrile; octadecane; 1,1,1,2-tetrachloroethane CAS Name: benzonitrile; octadecane; 1,1,1,2-tetrachloroethane IUPAC Name: benzonitrile; octadecane; 1,1,1,2-tetrachloroethane Traditional Name: benzonitrile; octadecane; 1,1,1,2-tetrachloroethane Formula: C27H45Cl4N MolecularWeight: 525.4649

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H38.C7H5N.C2H2Cl4/c1-3-5-7-9-11-13-15-17-18-16-14-12-10-8-6-4-2;8-6-7-4-2-1-3-5-7;3-1-2(4,5)6/h3-18H2,1-2H3;1-5H;1H2