1-(9-methylsulfonylnonyl)pyrene

Systemtic Name: 1-(9-methylsulfonylnonyl)pyrene Openeye Name: 1-(9-methylsulfonylnonyl)pyrene CAS Name: 1-(9-methylsulfonylnonyl)pyrene IUPAC Name: 1-(9-methylsulfonylnonyl)pyrene Traditional Name: 1-(9-mesylnonyl)pyrene Formula: C26H30O2S MolecularWeight: 406.5802

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCCCCCCCCC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

Isomeric SMILES

CS(=O)(=O)CCCCCCCCCC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

InChI

InChI=1S/C26H30O2S/c1-29(27,28)19-8-6-4-2-3-5-7-10-20-13-14-23-16-15-21-11-9-12-22-17-18-24(20)26(23)25(21)22/h9,11-18H,2-8,10,19H2,1H3