3-(hexadecylsulfanylmethyl)-4-oxidanyl-butanamide; phosphoric acid

Systemtic Name: 3-(hexadecylsulfanylmethyl)-4-oxidanyl-butanamide; phosphoric acid Openeye Name: 3-(hexadecylsulfanylmethyl)-4-hydroxy-butanamide; phosphoric acid CAS Name: 3-[(hexadecylthio)methyl]-4-hydroxybutanamide; phosphoric acid IUPAC Name: 3-(hexadecylsulfanylmethyl)-4-hydroxybutanamide; phosphoric acid Traditional Name: 3-[(cetylthio)methyl]-4-hydroxy-butyramide; phosphoric acid Formula: C21H46NO6PS MolecularWeight: 471.631801

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSCC(CC(=O)N)CO.OP(=O)(O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCSCC(CC(=O)N)CO.OP(=O)(O)O

InChI

InChI=1S/C21H43NO2S.H3O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-25-19-20(18-23)17-21(22)24;1-5(2,3)4/h20,23H,2-19H2,1H3,(H2,22,24);(H3,1,2,3,4)