2,2-bis(4-methoxy-3-methyl-phenyl)-2-oxidanyl-ethanoate; bromanylmethane

Systemtic Name: 2,2-bis(4-methoxy-3-methyl-phenyl)-2-oxidanyl-ethanoate; bromanylmethane Openeye Name: bromomethane; 2-hydroxy-2,2-bis(4-methoxy-3-methyl-phenyl)acetate CAS Name: bromomethane; 2-hydroxy-2,2-bis(4-methoxy-3-methylphenyl)acetate IUPAC Name: bromomethane; 2-hydroxy-2,2-bis(4-methoxy-3-methylphenyl)acetate Traditional Name: bromomethane; 2-hydroxy-2,2-bis(4-methoxy-3-methyl-phenyl)acetate Formula: C19H22BrO5- MolecularWeight: 410.27898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C2=CC(=C(C=C2)OC)C)(C(=O)[O-])O)OC.CBr

Isomeric SMILES

CC1=C(C=CC(=C1)C(C2=CC(=C(C=C2)OC)C)(C(=O)[O-])O)OC.CBr

InChI

InChI=1S/C18H20O5.CH3Br/c1-11-9-13(5-7-15(11)22-3)18(21,17(19)20)14-6-8-16(23-4)12(2)10-14;1-2/h5-10,21H,1-4H3,(H,19,20);1H3/p-1