N-[(2-bromanyl-4-methoxy-5-oxidanyl-phenyl)methyl]-2-(4-hydroxyphenyl)-N-methyl-ethanamine oxide

Systemtic Name: N-[(2-bromanyl-4-methoxy-5-oxidanyl-phenyl)methyl]-2-(4-hydroxyphenyl)-N-methyl-ethanamine oxide Openeye Name: N-[(2-bromo-5-hydroxy-4-methoxy-phenyl)methyl]-2-(4-hydroxyphenyl)-N-methyl-ethanamine oxide CAS Name: N-[(2-bromo-5-hydroxy-4-methoxyphenyl)methyl]-2-(4-hydroxyphenyl)-N-methylethanamine oxide IUPAC Name: N-[(2-bromo-5-hydroxy-4-methoxyphenyl)methyl]-2-(4-hydroxyphenyl)-N-methylethanamine oxide Traditional Name: N-(2-bromo-5-hydroxy-4-methoxy-benzyl)-2-(4-hydroxyphenyl)-N-methyl-ethanamine oxide Formula: C17H20BrNO4 MolecularWeight: 382.249

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](CCC1=CC=C(C=C1)O)(CC2=CC(=C(C=C2Br)OC)O)[O-]

Isomeric SMILES

C[N+](CCC1=CC=C(C=C1)O)(CC2=CC(=C(C=C2Br)OC)O)[O-]

InChI

InChI=1S/C17H20BrNO4/c1-19(22,8-7-12-3-5-14(20)6-4-12)11-13-9-16(21)17(23-2)10-15(13)18/h3-6,9-10,20-21H,7-8,11H2,1-2H3