sodium 5-[(2,6-dinaphthalen-2-yloxypyrimidin-4-yl)amino]-2-ethenyl-benzenesulfonate

Systemtic Name: sodium 5-[(2,6-dinaphthalen-2-yloxypyrimidin-4-yl)amino]-2-ethenyl-benzenesulfonate Openeye Name: sodium 5-[[2,6-bis(2-naphthyloxy)pyrimidin-4-yl]amino]-2-vinyl-benzenesulfonate CAS Name: sodium 5-[[2,6-bis(2-naphthalenyloxy)-4-pyrimidinyl]amino]-2-ethenylbenzenesulfonate IUPAC Name: sodium 5-[(2,6-dinaphthalen-2-yloxypyrimidin-4-yl)amino]-2-ethenylbenzenesulfonate Traditional Name: sodium 5-[[2,6-bis(2-naphthoxy)pyrimidin-4-yl]amino]-2-vinyl-besylate Formula: C32H22N3NaO5S MolecularWeight: 583.58895

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=C(C=C(C=C1)NC2=CC(=NC(=N2)OC3=CC4=CC=CC=C4C=C3)OC5=CC6=CC=CC=C6C=C5)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C=CC1=C(C=C(C=C1)NC2=CC(=NC(=N2)OC3=CC4=CC=CC=C4C=C3)OC5=CC6=CC=CC=C6C=C5)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C32H23N3O5S.Na/c1-2-21-11-14-26(19-29(21)41(36,37)38)33-30-20-31(39-27-15-12-22-7-3-5-9-24(22)17-27)35-32(34-30)40-28-16-13-23-8-4-6-10-25(23)18-28;/h2-20H,1H2,(H,33,34,35)(H,36,37,38);/q;+1/p-1