2,2-bis(4-chlorophenyl)-3,3-disulfo-butanedioic acid

Systemtic Name: 2,2-bis(4-chlorophenyl)-3,3-disulfo-butanedioic acid Openeye Name: 2,2-bis(4-chlorophenyl)-3,3-disulfo-butanedioic acid CAS Name: 2,2-bis(4-chlorophenyl)-3,3-disulfobutanedioic acid IUPAC Name: 2,2-bis(4-chlorophenyl)-3,3-disulfobutanedioic acid Traditional Name: 2,2-bis(4-chlorophenyl)-3,3-disulfo-succinic acid Formula: C16H12Cl2O10S2 MolecularWeight: 499.29648

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)(C(=O)O)C(C(=O)O)(S(=O)(=O)O)S(=O)(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)(C(=O)O)C(C(=O)O)(S(=O)(=O)O)S(=O)(=O)O)Cl

InChI

InChI=1S/C16H12Cl2O10S2/c17-11-5-1-9(2-6-11)15(13(19)20,10-3-7-12(18)8-4-10)16(14(21)22,29(23,24)25)30(26,27)28/h1-8H,(H,19,20)(H,21,22)(H,23,24,25)(H,26,27,28)