4-[(4-bromanyl-2-tert-butyl-6-methyl-phenoxy)methyl]-5-methyl-furan-2-carboxylate

Systemtic Name: 4-[(4-bromanyl-2-tert-butyl-6-methyl-phenoxy)methyl]-5-methyl-furan-2-carboxylate Openeye Name: 4-[(4-bromo-2-tert-butyl-6-methyl-phenoxy)methyl]-5-methyl-furan-2-carboxylate CAS Name: 4-[(4-bromo-2-tert-butyl-6-methylphenoxy)methyl]-5-methyl-2-furancarboxylate IUPAC Name: 4-[(4-bromo-2-tert-butyl-6-methylphenoxy)methyl]-5-methylfuran-2-carboxylate Traditional Name: 4-[(4-bromo-2-tert-butyl-6-methyl-phenoxy)methyl]-5-methyl-2-furoate Formula: C18H20BrO4- MolecularWeight: 380.253

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC2=C(OC(=C2)C(=O)[O-])C)C(C)(C)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC2=C(OC(=C2)C(=O)[O-])C)C(C)(C)C)Br

InChI

InChI=1S/C18H21BrO4/c1-10-6-13(19)8-14(18(3,4)5)16(10)22-9-12-7-15(17(20)21)23-11(12)2/h6-8H,9H2,1-5H3,(H,20,21)/p-1