[(E)-4,9,9-tris(phenylsulfonyl)dodec-6-en-1,11-diyn-4-yl]sulfonylbenzene

Systemtic Name: [(E)-4,9,9-tris(phenylsulfonyl)dodec-6-en-1,11-diyn-4-yl]sulfonylbenzene Openeye Name: [(E)-1,6,6-tris(benzenesulfonyl)-1-prop-2-ynyl-non-3-en-8-ynyl]sulfonylbenzene CAS Name: [(E)-4,9,9-tris(benzenesulfonyl)dodec-6-en-1,11-diyn-4-yl]sulfonylbenzene IUPAC Name: [(E)-4,9,9-tris(benzenesulfonyl)dodec-6-en-1,11-diyn-4-yl]sulfonylbenzene Traditional Name: [(E)-1,6,6-tribesyl-1-propargyl-non-3-en-8-ynyl]sulfonylbenzene Formula: C36H32O8S4 MolecularWeight: 720.89448

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Descriptors Computed from Structure

Canonical SMILES:

C#CCC(CC=CCC(CC#C)(S(=O)(=O)C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2)(S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C#CCC(C/C=C/CC(CC#C)(S(=O)(=O)C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2)(S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C36H32O8S4/c1-3-27-35(45(37,38)31-19-9-5-10-20-31,46(39,40)32-21-11-6-12-22-32)29-17-18-30-36(28-4-2,47(41,42)33-23-13-7-14-24-33)48(43,44)34-25-15-8-16-26-34/h1-2,5-26H,27-30H2/b18-17+