sodium; [(1E,3E)-hexa-1,3,5-trienyl]benzene; (E)-2-phenylethenesulfonic acid

Systemtic Name: sodium; [(1E,3E)-hexa-1,3,5-trienyl]benzene; (E)-2-phenylethenesulfonic acid Openeye Name: sodium; [(1E,3E)-hexa-1,3,5-trienyl]benzene; (E)-2-phenylethenesulfonic acid CAS Name: sodium; [(1E,3E)-hexa-1,3,5-trienyl]benzene; (E)-2-phenylethenesulfonic acid IUPAC Name: sodium; [(1E,3E)-hexa-1,3,5-trienyl]benzene; (E)-2-phenylethenesulfonic acid Traditional Name: sodium; [(1E,3E)-hexa-1,3,5-trienyl]benzene; (E)-2-phenylethenesulfonic acid Formula: C20H20NaO3S+ MolecularWeight: 363.42577

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Descriptors Computed from Structure

Canonical SMILES:

C=CC=CC=CC1=CC=CC=C1.C1=CC=C(C=C1)C=CS(=O)(=O)O.[Na+]

Isomeric SMILES

C=C/C=C/C=C/C1=CC=CC=C1.C1=CC=C(C=C1)/C=C/S(=O)(=O)O.[Na+]

InChI

InChI=1S/C12H12.C8H8O3S.Na/c1-2-3-4-6-9-12-10-7-5-8-11-12;9-12(10,11)7-6-8-4-2-1-3-5-8;/h2-11H,1H2;1-7H,(H,9,10,11);/q;;+1/b4-3+,9-6+;7-6+;