ethyl ethanoate; hexane

Systemtic Name: ethyl ethanoate; hexane Openeye Name: ethyl acetate; hexane CAS Name: acetic acid ethyl ester; hexane IUPAC Name: ethyl acetate; hexane Traditional Name: acetic acid ethyl ester; n-hexane Formula: C22H50O2 MolecularWeight: 346.6312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC.CCCCCC.CCCCCC.CCOC(=O)C

Isomeric SMILES

CCCCCC.CCCCCC.CCCCCC.CCOC(=O)C

InChI

InChI=1S/3C6H14.C4H8O2/c3*1-3-5-6-4-2;1-3-6-4(2)5/h3*3-6H2,1-2H3;3H2,1-2H3