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methylbenzene; propylbenzene; thiophosphate

methylbenzene; propylbenzene; thiophosphate

Systemtic Name:methylbenzene; propylbenzene; thiophosphate
Openeye Name:propylbenzene; toluene; thiophosphate
CAS Name:propylbenzene; toluene; thiophosphate
IUPAC Name:propylbenzene; toluene; thiophosphate
Traditional Name:propylbenzene; toluene; thiophosphate
Formula: C16H20O3PS-3
MolecularWeight: 323.366961
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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC=C1.CC1=CC=CC=C1.[O-]P(=S)([O-])[O-]


Isomeric SMILES

CCCC1=CC=CC=C1.CC1=CC=CC=C1.[O-]P(=S)([O-])[O-]


InChI

InChI=1S/C9H12.C7H8.H3O3PS/c1-2-6-9-7-4-3-5-8-9;1-7-5-3-2-4-6-7;1-4(2,3)5/h3-5,7-8H,2,6H2,1H3;2-6H,1H3;(H3,1,2,3,5)/p-3


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