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7-(triphenylmethyl)sulfanylheptane-1,3,3-tricarboxylic acid

7-(triphenylmethyl)sulfanylheptane-1,3,3-tricarboxylic acid

Systemtic Name:7-(triphenylmethyl)sulfanylheptane-1,3,3-tricarboxylic acid
Openeye Name:7-tritylsulfanylheptane-1,3,3-tricarboxylic acid
CAS Name:7-[(triphenylmethyl)thio]heptane-1,3,3-tricarboxylic acid
IUPAC Name:7-tritylsulfanylheptane-1,3,3-tricarboxylic acid
Traditional Name:7-(tritylthio)heptane-1,3,3-tricarboxylic acid
Formula: C29H30O6S
MolecularWeight: 506.6099
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Descriptors Computed from Structure

Canonical SMILES:

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


InChI

InChI=1S/C29H30O6S/c30-25(31)18-20-28(26(32)33,27(34)35)19-10-11-21-36-29(22-12-4-1-5-13-22,23-14-6-2-7-15-23)24-16-8-3-9-17-24/h1-9,12-17H,10-11,18-21H2,(H,30,31)(H,32,33)(H,34,35)


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