2-phenylsulfanylcyclododecan-1-one

Systemtic Name: 2-phenylsulfanylcyclododecan-1-one Openeye Name: 2-phenylsulfanylcyclododecanone CAS Name: 2-(phenylthio)-1-cyclododecanone IUPAC Name: 2-phenylsulfanylcyclododecan-1-one Traditional Name: 2-(phenylthio)cyclododecanone Formula: C18H26OS MolecularWeight: 290.46344

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCC(=O)C(CCCC1)SC2=CC=CC=C2

Isomeric SMILES

C1CCCCCC(=O)C(CCCC1)SC2=CC=CC=C2

InChI

InChI=1S/C18H26OS/c19-17-14-10-5-3-1-2-4-6-11-15-18(17)20-16-12-8-7-9-13-16/h7-9,12-13,18H,1-6,10-11,14-15H2