5-[(4-bromanyl-2-tert-butyl-5-methyl-phenoxy)methyl]furan-2-carboxylate

Systemtic Name: 5-[(4-bromanyl-2-tert-butyl-5-methyl-phenoxy)methyl]furan-2-carboxylate Openeye Name: 5-[(4-bromo-2-tert-butyl-5-methyl-phenoxy)methyl]furan-2-carboxylate CAS Name: 5-[(4-bromo-2-tert-butyl-5-methylphenoxy)methyl]-2-furancarboxylate IUPAC Name: 5-[(4-bromo-2-tert-butyl-5-methylphenoxy)methyl]furan-2-carboxylate Traditional Name: 5-[(4-bromo-2-tert-butyl-5-methyl-phenoxy)methyl]-2-furoate Formula: C17H18BrO4- MolecularWeight: 366.22642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C(C)(C)C)OCC2=CC=C(O2)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1Br)C(C)(C)C)OCC2=CC=C(O2)C(=O)[O-]

InChI

InChI=1S/C17H19BrO4/c1-10-7-15(12(8-13(10)18)17(2,3)4)21-9-11-5-6-14(22-11)16(19)20/h5-8H,9H2,1-4H3,(H,19,20)/p-1