aniline; methyl 6-bis(oxidanyl)phosphinothioylhexanoate

Systemtic Name: aniline; methyl 6-bis(oxidanyl)phosphinothioylhexanoate Openeye Name: aniline; methyl 6-dihydroxyphosphinothioylhexanoate CAS Name: aniline; 6-dihydroxyphosphinothioylhexanoic acid methyl ester IUPAC Name: aniline; methyl 6-dihydroxyphosphinothioylhexanoate Traditional Name: 6-dihydroxythiophosphorylhexanoic acid methyl ester; phenylamine Formula: C13H22NO4PS MolecularWeight: 319.356841

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCP(=S)(O)O.C1=CC=C(C=C1)N

Isomeric SMILES

COC(=O)CCCCCP(=S)(O)O.C1=CC=C(C=C1)N

InChI

InChI=1S/C7H15O4PS.C6H7N/c1-11-7(8)5-3-2-4-6-12(9,10)13;7-6-4-2-1-3-5-6/h2-6H2,1H3,(H2,9,10,13);1-5H,7H2