sodium 3-[(2,6-dinaphthalen-2-yloxypyrimidin-4-yl)amino]benzenesulfonate

Systemtic Name: sodium 3-[(2,6-dinaphthalen-2-yloxypyrimidin-4-yl)amino]benzenesulfonate Openeye Name: sodium 3-[[2,6-bis(2-naphthyloxy)pyrimidin-4-yl]amino]benzenesulfonate CAS Name: sodium 3-[[2,6-bis(2-naphthalenyloxy)-4-pyrimidinyl]amino]benzenesulfonate IUPAC Name: sodium 3-[(2,6-dinaphthalen-2-yloxypyrimidin-4-yl)amino]benzenesulfonate Traditional Name: sodium 3-[[2,6-bis(2-naphthoxy)pyrimidin-4-yl]amino]besylate Formula: C30H20N3NaO5S MolecularWeight: 557.55167

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)OC3=NC(=NC(=C3)NC4=CC(=CC=C4)S(=O)(=O)[O-])OC5=CC6=CC=CC=C6C=C5.[Na+]

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)OC3=NC(=NC(=C3)NC4=CC(=CC=C4)S(=O)(=O)[O-])OC5=CC6=CC=CC=C6C=C5.[Na+]

InChI

InChI=1S/C30H21N3O5S.Na/c34-39(35,36)27-11-5-10-24(18-27)31-28-19-29(37-25-14-12-20-6-1-3-8-22(20)16-25)33-30(32-28)38-26-15-13-21-7-2-4-9-23(21)17-26;/h1-19H,(H,31,32,33)(H,34,35,36);/q;+1/p-1