(heptanethioylamino) methyl phenethyl phosphate

Systemtic Name: (heptanethioylamino) methyl phenethyl phosphate Openeye Name: (heptanethioylamino) methyl phenethyl phosphate CAS Name: phosphoric acid methyl phenethyl (1-sulfanylideneheptylamino) ester IUPAC Name: (heptanethioylamino) methyl phenethyl phosphate Traditional Name: phosphoric acid (heptanethioylamino) methyl phenethyl ester Formula: C16H26NO4PS MolecularWeight: 359.420701

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=S)NOP(=O)(OC)OCCC1=CC=CC=C1

Isomeric SMILES

CCCCCCC(=S)NOP(=O)(OC)OCCC1=CC=CC=C1

InChI

InChI=1S/C16H26NO4PS/c1-3-4-5-9-12-16(23)17-21-22(18,19-2)20-14-13-15-10-7-6-8-11-15/h6-8,10-11H,3-5,9,12-14H2,1-2H3,(H,17,23)