sodium 4-(7H-benzo[a]phenalen-3-yloxy)benzenesulfonate

Systemtic Name: sodium 4-(7H-benzo[a]phenalen-3-yloxy)benzenesulfonate Openeye Name: sodium 4-(7H-benzo[a]phenalen-3-yloxy)benzenesulfonate CAS Name: sodium 4-(7H-benzo[a]phenalen-3-yloxy)benzenesulfonate IUPAC Name: sodium 4-(7H-benzo[a]phenalen-3-yloxy)benzenesulfonate Traditional Name: sodium 4-(7H-benzo[a]phenalen-3-yloxy)besylate Formula: C23H15NaO4S MolecularWeight: 410.41757

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C3=C4C1=CC=CC4=C(C=C3)OC5=CC=C(C=C5)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1C2=CC=CC=C2C3=C4C1=CC=CC4=C(C=C3)OC5=CC=C(C=C5)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C23H16O4S.Na/c24-28(25,26)18-10-8-17(9-11-18)27-22-13-12-20-19-6-2-1-4-15(19)14-16-5-3-7-21(22)23(16)20;/h1-13H,14H2,(H,24,25,26);/q;+1/p-1