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: C42H86O18 MolecularWeight: 879.12144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H14.9C4H8O2/c1-3-5-6-4-2;9*1-3-6-4(2)5/h3-6H2,1-2H3;9*3H2,1-2H3