ethane; methane; methanediol; methoxyethane; methoxymethane; molecular hydrogen; heptadecahydrate

Systemtic Name: ethane; methane; methanediol; methoxyethane; methoxymethane; molecular hydrogen; heptadecahydrate Openeye Name: ethane; methane; methanediol; methoxyethane; methoxymethane; molecular hydrogen; heptadecahydrate CAS Name: ethane; methane; methanediol; methoxyethane; methoxymethane; molecular hydrogen; heptadecahydrate IUPAC Name: ethane; methane; methanediol; methoxyethane; methoxymethane; molecular hydrogen; heptadecahydrate Traditional Name: ethane; methane; methanediol; methoxyethane; methoxymethane; molecular hydrogen; heptadecahydrate Formula: C50H232O22 MolecularWeight: 1186.36388

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Descriptors Computed from Structure

Canonical SMILES:

[HH].[HH].[HH].[HH].[HH].C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC.CC.CCOC.COC.COC.C(O)O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O

Isomeric SMILES

[HH].[HH].[HH].[HH].[HH].C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC.CC.CCOC.COC.COC.C(O)O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O

InChI

InChI=1S/C3H8O.2C2H6O.2C2H6.CH4O2.38CH4.17H2O.5H2/c1-3-4-2;2*1-3-2;2*1-2;2-1-3;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h3H2,1-2H3;2*1-2H3;2*1-2H3;2-3H,1H2;38*1H4;17*1H2;5*1H