tert-butyl 4-[[5,8-bis(bromanyl)naphthalen-2-yl]-oxidanyl-methyl]benzoate

Systemtic Name: tert-butyl 4-[[5,8-bis(bromanyl)naphthalen-2-yl]-oxidanyl-methyl]benzoate Openeye Name: tert-butyl 4-[(5,8-dibromo-2-naphthyl)-hydroxy-methyl]benzoate CAS Name: 4-[(5,8-dibromo-2-naphthalenyl)-hydroxymethyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(5,8-dibromonaphthalen-2-yl)-hydroxymethyl]benzoate Traditional Name: 4-[(5,8-dibromo-2-naphthyl)-hydroxy-methyl]benzoic acid tert-butyl ester Formula: C22H20Br2O3 MolecularWeight: 492.2004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC=C(C=C1)C(C2=CC3=C(C=CC(=C3C=C2)Br)Br)O

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC=C(C=C1)C(C2=CC3=C(C=CC(=C3C=C2)Br)Br)O

InChI

InChI=1S/C22H20Br2O3/c1-22(2,3)27-21(26)14-6-4-13(5-7-14)20(25)15-8-9-16-17(12-15)19(24)11-10-18(16)23/h4-12,20,25H,1-3H3