methanesulfonate; 1,2,4-triphenylbuta-1,3-dienylbenzene

Systemtic Name: methanesulfonate; 1,2,4-triphenylbuta-1,3-dienylbenzene Openeye Name: methanesulfonate; 1,2,4-triphenylbuta-1,3-dienylbenzene CAS Name: methanesulfonate; 1,2,4-triphenylbuta-1,3-dienylbenzene IUPAC Name: methanesulfonate; 1,2,4-triphenylbuta-1,3-dienylbenzene Traditional Name: 1,2,4-triphenylbuta-1,3-dienylbenzene mesylate Formula: C29H24O3S MolecularWeight: 452.56406

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)[O-].C1=CC=C(C=C1)C=[C+]C(=C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)[O-].C1=CC=C(C=C1)C=[C+]C(=C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H21.CH4O3S/c1-5-13-23(14-6-1)21-22-27(24-15-7-2-8-16-24)28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-5(2,3)4/h1-21H;1H3,(H,2,3,4)/q+1;/p-1