azane; butane; methane; methanol; molecular hydrogen; trihydrate

Systemtic Name: azane; butane; methane; methanol; molecular hydrogen; trihydrate Openeye Name: ammonia; butane; methane; methanol; molecular hydrogen; trihydrate CAS Name: ammonia; butane; methane; methanol; molecular hydrogen; trihydrate IUPAC Name: azane; butane; methane; methanol; molecular hydrogen; trihydrate Traditional Name: ammonia; methane; methanol; molecular hydrogen; n-butane; trihydrate Formula: C21H93NO4 MolecularWeight: 423.96742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[HH].[HH].[HH].C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CCCC.CO.N.O.O.O

Isomeric SMILES

[HH].[HH].[HH].C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CCCC.CO.N.O.O.O

InChI

InChI=1S/C4H10.CH4O.16CH4.H3N.3H2O.3H2/c1-3-4-2;1-2;;;;;;;;;;;;;;;;;;;;;;;/h3-4H2,1-2H3;2H,1H3;16*1H4;1H3;3*1H2;3*1H