4-(9-butylsulfanylfluoren-9-yl)butylphosphonic acid

Systemtic Name: 4-(9-butylsulfanylfluoren-9-yl)butylphosphonic acid Openeye Name: 4-(9-butylsulfanylfluoren-9-yl)butylphosphonic acid CAS Name: 4-[9-(butylthio)-9-fluorenyl]butylphosphonic acid IUPAC Name: 4-(9-butylsulfanylfluoren-9-yl)butylphosphonic acid Traditional Name: 4-[9-(butylthio)fluoren-9-yl]butylphosphonic acid Formula: C21H27O3PS MolecularWeight: 390.476041

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1(C2=CC=CC=C2C3=CC=CC=C31)CCCCP(=O)(O)O

Isomeric SMILES

CCCCSC1(C2=CC=CC=C2C3=CC=CC=C31)CCCCP(=O)(O)O

InChI

InChI=1S/C21H27O3PS/c1-2-3-16-26-21(14-8-9-15-25(22,23)24)19-12-6-4-10-17(19)18-11-5-7-13-20(18)21/h4-7,10-13H,2-3,8-9,14-16H2,1H3,(H2,22,23,24)