methyl 8-methylsulfanyl-9,10-diphenyl-fluoranthene-7-carboxylate

Systemtic Name: methyl 8-methylsulfanyl-9,10-diphenyl-fluoranthene-7-carboxylate Openeye Name: methyl 8-methylsulfanyl-9,10-diphenyl-fluoranthene-7-carboxylate CAS Name: 8-(methylthio)-9,10-diphenyl-7-fluoranthenecarboxylic acid methyl ester IUPAC Name: methyl 8-methylsulfanyl-9,10-diphenylfluoranthene-7-carboxylate Traditional Name: 8-(methylthio)-9,10-diphenyl-fluoranthene-7-carboxylic acid methyl ester Formula: C31H22O2S MolecularWeight: 458.57018

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C3=CC=CC4=C3C(=CC=C4)C2=C(C(=C1SC)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

COC(=O)C1=C2C3=CC=CC4=C3C(=CC=C4)C2=C(C(=C1SC)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H22O2S/c1-33-31(32)29-28-23-18-10-16-19-15-9-17-22(24(19)23)27(28)25(20-11-5-3-6-12-20)26(30(29)34-2)21-13-7-4-8-14-21/h3-18H,1-2H3