[(2R)-2-anthracen-9-ylcarbonylsulfanylhexyl] anthracene-9-carboxylate

Systemtic Name: [(2R)-2-anthracen-9-ylcarbonylsulfanylhexyl] anthracene-9-carboxylate Openeye Name: [(2R)-2-(anthracene-9-carbonylsulfanyl)hexyl] anthracene-9-carboxylate CAS Name: 9-anthracenecarboxylic acid [(2R)-2-[[9-anthracenyl(oxo)methyl]thio]hexyl] ester IUPAC Name: [(2R)-2-(anthracene-9-carbonylsulfanyl)hexyl] anthracene-9-carboxylate Traditional Name: anthracene-9-carboxylic acid [(2R)-2-(anthracene-9-carbonylthio)hexyl] ester Formula: C36H30O3S MolecularWeight: 542.6866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(COC(=O)C1=C2C=CC=CC2=CC3=CC=CC=C31)SC(=O)C4=C5C=CC=CC5=CC6=CC=CC=C64

Isomeric SMILES

CCCC[C@H](COC(=O)C1=C2C=CC=CC2=CC3=CC=CC=C31)SC(=O)C4=C5C=CC=CC5=CC6=CC=CC=C64

InChI

InChI=1S/C36H30O3S/c1-2-3-16-28(40-36(38)34-31-19-10-6-14-26(31)22-27-15-7-11-20-32(27)34)23-39-35(37)33-29-17-8-4-12-24(29)21-25-13-5-9-18-30(25)33/h4-15,17-22,28H,2-3,16,23H2,1H3/t28-/m1/s1