3-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)propanoate; 1,2-diethoxyethane

Systemtic Name: 3-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)propanoate; 1,2-diethoxyethane Openeye Name: 3-(3-tert-butyl-4-hydroxy-5-methyl-phenyl)propanoate; 1,2-diethoxyethane CAS Name: 3-(3-tert-butyl-4-hydroxy-5-methylphenyl)propanoate; 1,2-diethoxyethane IUPAC Name: 3-(3-tert-butyl-4-hydroxy-5-methylphenyl)propanoate; 1,2-diethoxyethane Traditional Name: 3-(3-tert-butyl-4-hydroxy-5-methyl-phenyl)propionate; 1,2-diethoxyethane Formula: C34H52O8-2 MolecularWeight: 588.77188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C14H20O3.C6H14O2/c2*1-9-7-10(5-6-12(15)16)8-11(13(9)17)14(2,3)4;1-3-7-5-6-8-4-2/h2*7-8,17H,5-6H2,1-4H3,(H,15,16);3-6H2,1-2H3/p-2