2,3-bis[(4-carboxyphenyl)sulfanyl]butanedioic acid

Systemtic Name: 2,3-bis[(4-carboxyphenyl)sulfanyl]butanedioic acid Openeye Name: 2,3-bis[(4-carboxyphenyl)sulfanyl]butanedioic acid CAS Name: 2,3-bis[(4-carboxyphenyl)thio]butanedioic acid IUPAC Name: 2,3-bis[(4-carboxyphenyl)sulfanyl]butanedioic acid Traditional Name: 2,3-bis[(4-carboxyphenyl)thio]succinic acid Formula: C18H14O8S2 MolecularWeight: 422.42896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)SC(C(C(=O)O)SC2=CC=C(C=C2)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)SC(C(C(=O)O)SC2=CC=C(C=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C18H14O8S2/c19-15(20)9-1-5-11(6-2-9)27-13(17(23)24)14(18(25)26)28-12-7-3-10(4-8-12)16(21)22/h1-8,13-14H,(H,19,20)(H,21,22)(H,23,24)(H,25,26)