4-[4-oxidanyl-2-(9-phosphonononanoylamino)thiophen-3-yl]oxybutanoic acid

Systemtic Name: 4-[4-oxidanyl-2-(9-phosphonononanoylamino)thiophen-3-yl]oxybutanoic acid Openeye Name: 4-[[4-hydroxy-2-(9-phosphonononanoylamino)-3-thienyl]oxy]butanoic acid CAS Name: 4-[[4-hydroxy-2-[(1-oxo-9-phosphonononyl)amino]-3-thiophenyl]oxy]butanoic acid IUPAC Name: 4-[4-hydroxy-2-(9-phosphonononanoylamino)thiophen-3-yl]oxybutanoic acid Traditional Name: 4-[[4-hydroxy-2-(9-phosphonononanoylamino)-3-thienyl]oxy]butyric acid Formula: C17H28NO8PS MolecularWeight: 437.444881

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(S1)NC(=O)CCCCCCCCP(=O)(O)O)OCCCC(=O)O)O

Isomeric SMILES

C1=C(C(=C(S1)NC(=O)CCCCCCCCP(=O)(O)O)OCCCC(=O)O)O

InChI

InChI=1S/C17H28NO8PS/c19-13-12-28-17(16(13)26-10-7-9-15(21)22)18-14(20)8-5-3-1-2-4-6-11-27(23,24)25/h12,19H,1-11H2,(H,18,20)(H,21,22)(H2,23,24,25)