(2S)-3-dibenzofuran-3-yl-2-[[(1R)-1-dimethoxyphosphoryl-5-methyl-hexyl]amino]propanoic acid

Systemtic Name: (2S)-3-dibenzofuran-3-yl-2-[[(1R)-1-dimethoxyphosphoryl-5-methyl-hexyl]amino]propanoic acid Openeye Name: (2S)-3-dibenzofuran-3-yl-2-[[(1R)-1-dimethoxyphosphoryl-5-methyl-hexyl]amino]propanoic acid CAS Name: (2S)-3-(3-dibenzofuranyl)-2-[[(1R)-1-dimethoxyphosphoryl-5-methylhexyl]amino]propanoic acid IUPAC Name: (2S)-3-dibenzofuran-3-yl-2-[[(1R)-1-dimethoxyphosphoryl-5-methylhexyl]amino]propanoic acid Traditional Name: (2S)-3-dibenzofuran-3-yl-2-[[(1R)-1-dimethoxyphosphoryl-5-methyl-hexyl]amino]propionic acid Formula: C24H32NO6P MolecularWeight: 461.487741

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(NC(CC1=CC2=C(C=C1)C3=CC=CC=C3O2)C(=O)O)P(=O)(OC)OC

Isomeric SMILES

CC(C)CCC[C@H](N[C@@H](CC1=CC2=C(C=C1)C3=CC=CC=C3O2)C(=O)O)P(=O)(OC)OC

InChI

InChI=1S/C24H32NO6P/c1-16(2)8-7-11-23(32(28,29-3)30-4)25-20(24(26)27)14-17-12-13-19-18-9-5-6-10-21(18)31-22(19)15-17/h5-6,9-10,12-13,15-16,20,23,25H,7-8,11,14H2,1-4H3,(H,26,27)/t20-,23+/m0/s1