9,10-bis[[[2-(dihydroxyboranyl)phenyl]methyl-methyl-amino]methyl]anthracene-2-carboxylic acid

Systemtic Name: 9,10-bis[[[2-(dihydroxyboranyl)phenyl]methyl-methyl-amino]methyl]anthracene-2-carboxylic acid Openeye Name: 9,10-bis[[(2-boronophenyl)methyl-methyl-amino]methyl]anthracene-2-carboxylic acid CAS Name: 9,10-bis[[(2-boronophenyl)methyl-methylamino]methyl]-2-anthracenecarboxylic acid IUPAC Name: 9,10-bis[[(2-boronophenyl)methyl-methylamino]methyl]anthracene-2-carboxylic acid Traditional Name: 9,10-bis[[(2-boronobenzyl)-methyl-amino]methyl]anthracene-2-carboxylic acid Formula: C33H34B2N2O6 MolecularWeight: 576.25486

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=CC=C1CN(C)CC2=C3C=CC(=CC3=C(C4=CC=CC=C42)CN(C)CC5=CC=CC=C5B(O)O)C(=O)O)(O)O

Isomeric SMILES

B(C1=CC=CC=C1CN(C)CC2=C3C=CC(=CC3=C(C4=CC=CC=C42)CN(C)CC5=CC=CC=C5B(O)O)C(=O)O)(O)O

InChI

InChI=1S/C33H34B2N2O6/c1-36(18-23-9-3-7-13-31(23)34(40)41)20-29-25-11-5-6-12-26(25)30(28-17-22(33(38)39)15-16-27(28)29)21-37(2)19-24-10-4-8-14-32(24)35(42)43/h3-17,40-43H,18-21H2,1-2H3,(H,38,39)