(3-diethoxyphosphoryl-6,7-dihydro-5H-1,4-dithiepin-2-yl)-phenyl-methanone

Systemtic Name: (3-diethoxyphosphoryl-6,7-dihydro-5H-1,4-dithiepin-2-yl)-phenyl-methanone Openeye Name: (3-diethoxyphosphoryl-6,7-dihydro-5H-1,4-dithiepin-2-yl)-phenyl-methanone CAS Name: (3-diethoxyphosphoryl-6,7-dihydro-5H-1,4-dithiepin-2-yl)-phenylmethanone IUPAC Name: (3-diethoxyphosphoryl-6,7-dihydro-5H-1,4-dithiepin-2-yl)-phenylmethanone Traditional Name: (3-diethoxyphosphoryl-6,7-dihydro-5H-1,4-dithiepin-2-yl)-phenyl-methanone Formula: C16H21O4PS2 MolecularWeight: 372.439301

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=C(SCCCS1)C(=O)C2=CC=CC=C2)OCC

Isomeric SMILES

CCOP(=O)(C1=C(SCCCS1)C(=O)C2=CC=CC=C2)OCC

InChI

InChI=1S/C16H21O4PS2/c1-3-19-21(18,20-4-2)16-15(22-11-8-12-23-16)14(17)13-9-6-5-7-10-13/h5-7,9-10H,3-4,8,11-12H2,1-2H3