2-(4-methyl-2-oxidanyl-phenyl)propyl 2-methylpropanoate; 2-methylpropanoate

Systemtic Name: 2-(4-methyl-2-oxidanyl-phenyl)propyl 2-methylpropanoate; 2-methylpropanoate Openeye Name: 2-(2-hydroxy-4-methyl-phenyl)propyl 2-methylpropanoate; 2-methylpropanoate CAS Name: 2-methylpropanoate; 2-methylpropanoic acid 2-(2-hydroxy-4-methylphenyl)propyl ester IUPAC Name: 2-(2-hydroxy-4-methylphenyl)propyl 2-methylpropanoate; 2-methylpropanoate Traditional Name: 2-methylpropionic acid 2-(2-hydroxy-4-methyl-phenyl)propyl ester isobutyrate Formula: C18H27O5- MolecularWeight: 323.40398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)COC(=O)C(C)C)O.CC(C)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)COC(=O)C(C)C)O.CC(C)C(=O)[O-]

InChI

InChI=1S/C14H20O3.C4H8O2/c1-9(2)14(16)17-8-11(4)12-6-5-10(3)7-13(12)15;1-3(2)4(5)6/h5-7,9,11,15H,8H2,1-4H3;3H,1-2H3,(H,5,6)/p-1