3-bis(2,6-dimethyl-3-sulfo-phenyl)phosphanyl-2,4-dimethyl-benzenesulfonic acid

Systemtic Name: 3-bis(2,6-dimethyl-3-sulfo-phenyl)phosphanyl-2,4-dimethyl-benzenesulfonic acid Openeye Name: 3-bis(2,6-dimethyl-3-sulfo-phenyl)phosphanyl-2,4-dimethyl-benzenesulfonic acid CAS Name: 3-bis(2,6-dimethyl-3-sulfophenyl)phosphino-2,4-dimethylbenzenesulfonic acid IUPAC Name: 3-bis(2,6-dimethyl-3-sulfophenyl)phosphanyl-2,4-dimethylbenzenesulfonic acid Traditional Name: 3-bis(2,6-dimethyl-3-sulfo-phenyl)phosphino-2,4-dimethyl-besylic acid Formula: C24H27O9PS3 MolecularWeight: 586.634541

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)S(=O)(=O)O)C)P(C2=C(C=CC(=C2C)S(=O)(=O)O)C)C3=C(C=CC(=C3C)S(=O)(=O)O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)S(=O)(=O)O)C)P(C2=C(C=CC(=C2C)S(=O)(=O)O)C)C3=C(C=CC(=C3C)S(=O)(=O)O)C

InChI

InChI=1S/C24H27O9PS3/c1-13-7-10-19(35(25,26)27)16(4)22(13)34(23-14(2)8-11-20(17(23)5)36(28,29)30)24-15(3)9-12-21(18(24)6)37(31,32)33/h7-12H,1-6H3,(H,25,26,27)(H,28,29,30)(H,31,32,33)