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

Systemtic Name: methyl (2S)-3-dibenzofuran-3-yl-2-[[(1R)-1-dimethoxyphosphoryl-5-methyl-hexyl]amino]propanoate Openeye Name: methyl (2S)-3-dibenzofuran-3-yl-2-[[(1R)-1-dimethoxyphosphoryl-5-methyl-hexyl]amino]propanoate CAS Name: (2S)-3-(3-dibenzofuranyl)-2-[[(1R)-1-dimethoxyphosphoryl-5-methylhexyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-dibenzofuran-3-yl-2-[[(1R)-1-dimethoxyphosphoryl-5-methylhexyl]amino]propanoate Traditional Name: (2S)-3-dibenzofuran-3-yl-2-[[(1R)-1-dimethoxyphosphoryl-5-methyl-hexyl]amino]propionic acid methyl ester Formula: C25H34NO6P MolecularWeight: 475.514321

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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)OC)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)OC)P(=O)(OC)OC

InChI

InChI=1S/C25H34NO6P/c1-17(2)9-8-12-24(33(28,30-4)31-5)26-21(25(27)29-3)15-18-13-14-20-19-10-6-7-11-22(19)32-23(20)16-18/h6-7,10-11,13-14,16-17,21,24,26H,8-9,12,15H2,1-5H3/t21-,24+/m0/s1