cyclohexane; ethyl ethanoate; methylbenzene

Systemtic Name: cyclohexane; ethyl ethanoate; methylbenzene Openeye Name: cyclohexane; ethyl acetate; toluene CAS Name: acetic acid ethyl ester; cyclohexane; toluene IUPAC Name: cyclohexane; ethyl acetate; toluene Traditional Name: acetic acid ethyl ester; cyclohexane; toluene Formula: C17H28O2 MolecularWeight: 264.40302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C.CC1=CC=CC=C1.C1CCCCC1

Isomeric SMILES

CCOC(=O)C.CC1=CC=CC=C1.C1CCCCC1

InChI

InChI=1S/C7H8.C6H12.C4H8O2/c1-7-5-3-2-4-6-7;1-2-4-6-5-3-1;1-3-6-4(2)5/h2-6H,1H3;1-6H2;3H2,1-2H3