benzene; ethane; methylbenzene; thiophosphate

Systemtic Name: benzene; ethane; methylbenzene; thiophosphate Openeye Name: benzene; ethane; toluene; thiophosphate CAS Name: benzene; ethane; toluene; thiophosphate IUPAC Name: benzene; ethane; toluene; thiophosphate Traditional Name: benzene; ethane; toluene; thiophosphate Formula: C15H20O3PS-3 MolecularWeight: 311.356261

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Descriptors Computed from Structure

Canonical SMILES:

CC.CC1=CC=CC=C1.C1=CC=CC=C1.[O-]P(=S)([O-])[O-]

Isomeric SMILES

CC.CC1=CC=CC=C1.C1=CC=CC=C1.[O-]P(=S)([O-])[O-]

InChI

InChI=1S/C7H8.C6H6.C2H6.H3O3PS/c1-7-5-3-2-4-6-7;1-2-4-6-5-3-1;1-2;1-4(2,3)5/h2-6H,1H3;1-6H;1-2H3;(H3,1,2,3,5)/p-3