5-(2-tert-butyl-5-methyl-phenoxy)pentanoate

Systemtic Name: 5-(2-tert-butyl-5-methyl-phenoxy)pentanoate Openeye Name: 5-(2-tert-butyl-5-methyl-phenoxy)pentanoate CAS Name: 5-(2-tert-butyl-5-methylphenoxy)pentanoate IUPAC Name: 5-(2-tert-butyl-5-methylphenoxy)pentanoate Traditional Name: 5-(2-tert-butyl-5-methyl-phenoxy)valerate Formula: C16H23O3- MolecularWeight: 263.35202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)(C)C)OCCCCC(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)(C)C)OCCCCC(=O)[O-]

InChI

InChI=1S/C16H24O3/c1-12-8-9-13(16(2,3)4)14(11-12)19-10-6-5-7-15(17)18/h8-9,11H,5-7,10H2,1-4H3,(H,17,18)/p-1