ethyl ethanoate; hexane; methylbenzene

Systemtic Name: ethyl ethanoate; hexane; methylbenzene Openeye Name: ethyl acetate; hexane; toluene CAS Name: acetic acid ethyl ester; hexane; toluene IUPAC Name: ethyl acetate; hexane; toluene Traditional Name: acetic acid ethyl ester; n-hexane; toluene Formula: C17H30O2 MolecularWeight: 266.4189

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC.CCOC(=O)C.CC1=CC=CC=C1

Isomeric SMILES

CCCCCC.CCOC(=O)C.CC1=CC=CC=C1

InChI

InChI=1S/C7H8.C6H14.C4H8O2/c1-7-5-3-2-4-6-7;1-3-5-6-4-2;1-3-6-4(2)5/h2-6H,1H3;3-6H2,1-2H3;3H2,1-2H3