[(3S)-3-anthracen-2-ylcarbonylsulfanylhexyl] anthracene-2-carboxylate

Systemtic Name: [(3S)-3-anthracen-2-ylcarbonylsulfanylhexyl] anthracene-2-carboxylate Openeye Name: [(3S)-3-(anthracene-2-carbonylsulfanyl)hexyl] anthracene-2-carboxylate CAS Name: 2-anthracenecarboxylic acid [(3S)-3-[[2-anthracenyl(oxo)methyl]thio]hexyl] ester IUPAC Name: [(3S)-3-(anthracene-2-carbonylsulfanyl)hexyl] anthracene-2-carboxylate Traditional Name: anthracene-2-carboxylic acid [(3S)-3-(anthracene-2-carbonylthio)hexyl] ester Formula: C36H30O3S MolecularWeight: 542.6866

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCOC(=O)C1=CC2=CC3=CC=CC=C3C=C2C=C1)SC(=O)C4=CC5=CC6=CC=CC=C6C=C5C=C4

Isomeric SMILES

CCC[C@@H](CCOC(=O)C1=CC2=CC3=CC=CC=C3C=C2C=C1)SC(=O)C4=CC5=CC6=CC=CC=C6C=C5C=C4

InChI

InChI=1S/C36H30O3S/c1-2-7-34(40-36(38)31-15-13-29-19-25-9-4-6-11-27(25)21-33(29)23-31)16-17-39-35(37)30-14-12-28-18-24-8-3-5-10-26(24)20-32(28)22-30/h3-6,8-15,18-23,34H,2,7,16-17H2,1H3/t34-/m0/s1