[(2S)-2-azaniumyl-4-(4-octylphenyl)-2-oxidanyl-butyl] hydrogen phosphate

Systemtic Name: [(2S)-2-azaniumyl-4-(4-octylphenyl)-2-oxidanyl-butyl] hydrogen phosphate Openeye Name: [(2S)-2-azaniumyl-2-hydroxy-4-(4-octylphenyl)butyl] hydrogen phosphate CAS Name: [(2S)-2-ammonio-2-hydroxy-4-(4-octylphenyl)butyl] hydrogen phosphate IUPAC Name: [(2S)-2-azaniumyl-2-hydroxy-4-(4-octylphenyl)butyl] hydrogen phosphate Traditional Name: [(2S)-2-ammonio-2-hydroxy-4-(4-octylphenyl)butyl] hydrogen phosphate Formula: C18H32NO5P MolecularWeight: 373.424141

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)CCC(COP(=O)(O)[O-])([NH3+])O

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)CC[C@](COP(=O)(O)[O-])([NH3+])O

InChI

InChI=1S/C18H32NO5P/c1-2-3-4-5-6-7-8-16-9-11-17(12-10-16)13-14-18(19,20)15-24-25(21,22)23/h9-12,20H,2-8,13-15,19H2,1H3,(H2,21,22,23)/t18-/m0/s1