heptane; tris(chloranyl)methane; hydrate

Systemtic Name: heptane; tris(chloranyl)methane; hydrate Openeye Name: chloroform; heptane; hydrate CAS Name: chloroform; heptane; hydrate IUPAC Name: chloroform; heptane; hydrate Traditional Name: chloroform; n-heptane; hydrate Formula: C9H20Cl6O MolecularWeight: 356.9725

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.O

Isomeric SMILES

CCCCCCC.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.O

InChI

InChI=1S/C7H16.2CHCl3.H2O/c1-3-5-7-6-4-2;2*2-1(3)4;/h3-7H2,1-2H3;2*1H;1H2