[[3,5-dimethyl-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]amino]methyl-methyl-phosphinic acid hydrobromide

Systemtic Name: [[3,5-dimethyl-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]amino]methyl-methyl-phosphinic acid hydrobromide Openeye Name: [4-(4-hydroxy-3-isopropyl-phenoxy)-3,5-dimethyl-anilino]methyl-methyl-phosphinic acid hydrobromide CAS Name: [4-(4-hydroxy-3-propan-2-ylphenoxy)-3,5-dimethylanilino]methyl-methylphosphinic acid hydrobromide IUPAC Name: [4-(4-hydroxy-3-propan-2-ylphenoxy)-3,5-dimethylanilino]methyl-methylphosphinic acid hydrobromide Traditional Name: [4-(4-hydroxy-3-isopropyl-phenoxy)-3,5-dimethyl-anilino]methyl-methyl-phosphinic acid hydrobromide Formula: C19H27BrNO4P MolecularWeight: 444.299741

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)C(C)C)C)NCP(=O)(C)O.Br

Isomeric SMILES

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)C(C)C)C)NCP(=O)(C)O.Br

InChI

InChI=1S/C19H26NO4P.BrH/c1-12(2)17-10-16(6-7-18(17)21)24-19-13(3)8-15(9-14(19)4)20-11-25(5,22)23;/h6-10,12,20-21H,11H2,1-5H3,(H,22,23);1H