2-[2,4-bis[(3,4-dimethylphenyl)sulfonyl]phenyl]-3,4-dimethyl-benzenesulfonic acid

Systemtic Name: 2-[2,4-bis[(3,4-dimethylphenyl)sulfonyl]phenyl]-3,4-dimethyl-benzenesulfonic acid Openeye Name: 2-[2,4-bis[(3,4-dimethylphenyl)sulfonyl]phenyl]-3,4-dimethyl-benzenesulfonic acid CAS Name: 2-[2,4-bis[(3,4-dimethylphenyl)sulfonyl]phenyl]-3,4-dimethylbenzenesulfonic acid IUPAC Name: 2-[2,4-bis[(3,4-dimethylphenyl)sulfonyl]phenyl]-3,4-dimethylbenzenesulfonic acid Traditional Name: 2-[2,4-bis[(3,4-dimethylphenyl)sulfonyl]phenyl]-3,4-dimethyl-besylic acid Formula: C30H30O7S3 MolecularWeight: 598.75

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C2=CC(=C(C=C2)C3=C(C=CC(=C3C)C)S(=O)(=O)O)S(=O)(=O)C4=CC(=C(C=C4)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C2=CC(=C(C=C2)C3=C(C=CC(=C3C)C)S(=O)(=O)O)S(=O)(=O)C4=CC(=C(C=C4)C)C)C

InChI

InChI=1S/C30H30O7S3/c1-18-7-10-24(15-21(18)4)38(31,32)26-12-13-27(30-23(6)20(3)9-14-28(30)40(35,36)37)29(17-26)39(33,34)25-11-8-19(2)22(5)16-25/h7-17H,1-6H3,(H,35,36,37)