8-(triphenylmethyl)sulfanyloctane-1,3,3-tricarboxylic acid

Systemtic Name: 8-(triphenylmethyl)sulfanyloctane-1,3,3-tricarboxylic acid Openeye Name: 8-tritylsulfanyloctane-1,3,3-tricarboxylic acid CAS Name: 8-[(triphenylmethyl)thio]octane-1,3,3-tricarboxylic acid IUPAC Name: 8-tritylsulfanyloctane-1,3,3-tricarboxylic acid Traditional Name: 8-(tritylthio)octane-1,3,3-tricarboxylic acid Formula: C30H32O6S MolecularWeight: 520.63648

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)SCCCCCC(CCC(=O)O)(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)SCCCCCC(CCC(=O)O)(C(=O)O)C(=O)O

InChI

InChI=1S/C30H32O6S/c31-26(32)19-21-29(27(33)34,28(35)36)20-11-4-12-22-37-30(23-13-5-1-6-14-23,24-15-7-2-8-16-24)25-17-9-3-10-18-25/h1-3,5-10,13-18H,4,11-12,19-22H2,(H,31,32)(H,33,34)(H,35,36)