benzene; propane; triphosphate

Systemtic Name: benzene; propane; triphosphate Openeye Name: benzene; propane; triphosphate CAS Name: benzene; propane; triphosphate IUPAC Name: benzene; propane; triphosphate Traditional Name: benzene; n-propane; triphosphate Formula: C18H38O12P3-9 MolecularWeight: 539.408403

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Descriptors Computed from Structure

Canonical SMILES:

CCC.CCC.CCC.CCC.C1=CC=CC=C1.[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-]

Isomeric SMILES

CCC.CCC.CCC.CCC.C1=CC=CC=C1.[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C6H6.4C3H8.3H3O4P/c1-2-4-6-5-3-1;4*1-3-2;3*1-5(2,3)4/h1-6H;4*3H2,1-2H3;3*(H3,1,2,3,4)/p-9