2-propyl-4-(triphenylmethyl)sulfanyl-pentanedioic acid

Systemtic Name: 2-propyl-4-(triphenylmethyl)sulfanyl-pentanedioic acid Openeye Name: 2-propyl-4-tritylsulfanyl-pentanedioic acid CAS Name: 2-propyl-4-[(triphenylmethyl)thio]pentanedioic acid IUPAC Name: 2-propyl-4-tritylsulfanylpentanedioic acid Traditional Name: 2-propyl-4-(tritylthio)glutaric acid Formula: C27H28O4S MolecularWeight: 448.57382

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC(C(=O)O)SC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCC(CC(C(=O)O)SC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C27H28O4S/c1-2-12-20(25(28)29)19-24(26(30)31)32-27(21-13-6-3-7-14-21,22-15-8-4-9-16-22)23-17-10-5-11-18-23/h3-11,13-18,20,24H,2,12,19H2,1H3,(H,28,29)(H,30,31)