methyl 4-[[4-bromanyl-2,5-bis(oxidanyl)phenyl]methylamino]-2-oxidanyl-benzoate

Systemtic Name: methyl 4-[[4-bromanyl-2,5-bis(oxidanyl)phenyl]methylamino]-2-oxidanyl-benzoate Openeye Name: methyl 4-[(4-bromo-2,5-dihydroxy-phenyl)methylamino]-2-hydroxy-benzoate CAS Name: 4-[(4-bromo-2,5-dihydroxyphenyl)methylamino]-2-hydroxybenzoic acid methyl ester IUPAC Name: methyl 4-[(4-bromo-2,5-dihydroxyphenyl)methylamino]-2-hydroxybenzoate Traditional Name: 4-[(4-bromo-2,5-dihydroxy-benzyl)amino]-2-hydroxy-benzoic acid methyl ester Formula: C15H14BrNO5 MolecularWeight: 368.17936

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)NCC2=CC(=C(C=C2O)Br)O)O

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)NCC2=CC(=C(C=C2O)Br)O)O

InChI

InChI=1S/C15H14BrNO5/c1-22-15(21)10-3-2-9(5-13(10)19)17-7-8-4-14(20)11(16)6-12(8)18/h2-6,17-20H,7H2,1H3