1-diphenylphosphanyl-2,2-dimethyl-heptan-1-one; sulfane

Systemtic Name: 1-diphenylphosphanyl-2,2-dimethyl-heptan-1-one; sulfane Openeye Name: 1-diphenylphosphanyl-2,2-dimethyl-heptan-1-one; hydrogen sulfide CAS Name: 1-diphenylphosphino-2,2-dimethyl-1-heptanone; sulfane IUPAC Name: 1-diphenylphosphanyl-2,2-dimethylheptan-1-one; sulfane Traditional Name: 1-diphenylphosphino-2,2-dimethyl-heptan-1-one; hydrogen sulfide Formula: C21H29OPS MolecularWeight: 360.493121

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C)C(=O)P(C1=CC=CC=C1)C2=CC=CC=C2.S

Isomeric SMILES

CCCCCC(C)(C)C(=O)P(C1=CC=CC=C1)C2=CC=CC=C2.S

InChI

InChI=1S/C21H27OP.H2S/c1-4-5-12-17-21(2,3)20(22)23(18-13-8-6-9-14-18)19-15-10-7-11-16-19;/h6-11,13-16H,4-5,12,17H2,1-3H3;1H2