7-bis(hexylsulfanyl)phosphoryloxy-2,3-dihydroinden-1-one

Systemtic Name: 7-bis(hexylsulfanyl)phosphoryloxy-2,3-dihydroinden-1-one Openeye Name: 7-bis(hexylsulfanyl)phosphoryloxyindan-1-one CAS Name: 7-bis(hexylthio)phosphoryloxy-2,3-dihydroinden-1-one IUPAC Name: 7-bis(hexylsulfanyl)phosphoryloxy-2,3-dihydroinden-1-one Traditional Name: 7-bis(hexylthio)phosphoryloxyindan-1-one Formula: C21H33O3PS2 MolecularWeight: 428.588681

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSP(=O)(OC1=CC=CC2=C1C(=O)CC2)SCCCCCC

Isomeric SMILES

CCCCCCSP(=O)(OC1=CC=CC2=C1C(=O)CC2)SCCCCCC

InChI

InChI=1S/C21H33O3PS2/c1-3-5-7-9-16-26-25(23,27-17-10-8-6-4-2)24-20-13-11-12-18-14-15-19(22)21(18)20/h11-13H,3-10,14-17H2,1-2H3