5-[[2,5-bis(oxidanyl)phenyl]methyl-[(2-hydroxyphenyl)methyl]amino]-2-oxidanyl-benzoate

Systemtic Name: 5-[[2,5-bis(oxidanyl)phenyl]methyl-[(2-hydroxyphenyl)methyl]amino]-2-oxidanyl-benzoate Openeye Name: 5-[(2,5-dihydroxyphenyl)methyl-[(2-hydroxyphenyl)methyl]amino]-2-hydroxy-benzoate CAS Name: 5-[(2,5-dihydroxyphenyl)methyl-[(2-hydroxyphenyl)methyl]amino]-2-hydroxybenzoate IUPAC Name: 5-[(2,5-dihydroxyphenyl)methyl-[(2-hydroxyphenyl)methyl]amino]-2-hydroxybenzoate Traditional Name: 5-[(2,5-dihydroxybenzyl)-salicyl-amino]-2-hydroxy-benzoate Formula: C21H18NO6- MolecularWeight: 380.37072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN(CC2=C(C=CC(=C2)O)O)C3=CC(=C(C=C3)O)C(=O)[O-])O

Isomeric SMILES

C1=CC=C(C(=C1)CN(CC2=C(C=CC(=C2)O)O)C3=CC(=C(C=C3)O)C(=O)[O-])O

InChI

InChI=1S/C21H19NO6/c23-16-6-8-19(25)14(9-16)12-22(11-13-3-1-2-4-18(13)24)15-5-7-20(26)17(10-15)21(27)28/h1-10,23-26H,11-12H2,(H,27,28)/p-1