methyl 4-bromanyl-7-tert-butyl-3-oxidanyl-naphthalene-2-carboxylate

Systemtic Name: methyl 4-bromanyl-7-tert-butyl-3-oxidanyl-naphthalene-2-carboxylate Openeye Name: methyl 4-bromo-7-tert-butyl-3-hydroxy-naphthalene-2-carboxylate CAS Name: 4-bromo-7-tert-butyl-3-hydroxy-2-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 4-bromo-7-tert-butyl-3-hydroxynaphthalene-2-carboxylate Traditional Name: 4-bromo-7-tert-butyl-3-hydroxy-naphthalene-2-carboxylic acid methyl ester Formula: C16H17BrO3 MolecularWeight: 337.20838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=CC(=C(C(=C2C=C1)Br)O)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC2=CC(=C(C(=C2C=C1)Br)O)C(=O)OC

InChI

InChI=1S/C16H17BrO3/c1-16(2,3)10-5-6-11-9(7-10)8-12(15(19)20-4)14(18)13(11)17/h5-8,18H,1-4H3