4-bis(oxidanyl)phosphinothioyloxybutyl diphenyl phosphate; N,N-diethylethanamine

Systemtic Name: 4-bis(oxidanyl)phosphinothioyloxybutyl diphenyl phosphate; N,N-diethylethanamine Openeye Name: N,N-diethylethanamine; 4-dihydroxyphosphinothioyloxybutyl diphenyl phosphate CAS Name: N,N-diethylethanamine; phosphoric acid 4-dihydroxyphosphinothioyloxybutyl diphenyl ester IUPAC Name: N,N-diethylethanamine; 4-dihydroxyphosphinothioyloxybutyl diphenyl phosphate Traditional Name: phosphoric acid 4-dihydroxythiophosphoryloxybutyl diphenyl ester; triethylamine Formula: C22H35NO7P2S MolecularWeight: 519.528322

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.C1=CC=C(C=C1)OP(=O)(OCCCCOP(=S)(O)O)OC2=CC=CC=C2

Isomeric SMILES

CCN(CC)CC.C1=CC=C(C=C1)OP(=O)(OCCCCOP(=S)(O)O)OC2=CC=CC=C2

InChI

InChI=1S/C16H20O7P2S.C6H15N/c17-24(18,26)20-13-7-8-14-21-25(19,22-15-9-3-1-4-10-15)23-16-11-5-2-6-12-16;1-4-7(5-2)6-3/h1-6,9-12H,7-8,13-14H2,(H2,17,18,26);4-6H2,1-3H3