ethyl ethanoate; methanoic acid; methylbenzene; 2-methylpropan-2-ol

Systemtic Name: ethyl ethanoate; methanoic acid; methylbenzene; 2-methylpropan-2-ol Openeye Name: ethyl acetate; formic acid; 2-methylpropan-2-ol; toluene CAS Name: acetic acid ethyl ester; formic acid; 2-methyl-2-propanol; toluene IUPAC Name: ethyl acetate; formic acid; 2-methylpropan-2-ol; toluene Traditional Name: acetic acid ethyl ester; formic acid; 2-methylpropan-2-ol; toluene Formula: C16H28O5 MolecularWeight: 300.39052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H8.C4H8O2.C4H10O.CH2O2/c1-7-5-3-2-4-6-7;1-3-6-4(2)5;1-4(2,3)5;2-1-3/h2-6H,1H3;3H2,1-2H3;5H,1-3H3;1H,(H,2,3)