3-[decyl-[3-(4-phenylphenyl)-2-(phosphonomethylamino)propanoyl]amino]propanoate

Systemtic Name: 3-[decyl-[3-(4-phenylphenyl)-2-(phosphonomethylamino)propanoyl]amino]propanoate Openeye Name: 3-[decyl-[3-(4-phenylphenyl)-2-(phosphonomethylamino)propanoyl]amino]propanoate CAS Name: 3-[decyl-[1-oxo-3-(4-phenylphenyl)-2-(phosphonomethylamino)propyl]amino]propanoate IUPAC Name: 3-[decyl-[3-(4-phenylphenyl)-2-(phosphonomethylamino)propanoyl]amino]propanoate Traditional Name: 3-[decyl-[3-(4-phenylphenyl)-2-(phosphonomethylamino)propanoyl]amino]propionate Formula: C29H42N2O6P- MolecularWeight: 545.627341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCN(CCC(=O)[O-])C(=O)C(CC1=CC=C(C=C1)C2=CC=CC=C2)NCP(=O)(O)O

Isomeric SMILES

CCCCCCCCCCN(CCC(=O)[O-])C(=O)C(CC1=CC=C(C=C1)C2=CC=CC=C2)NCP(=O)(O)O

InChI

InChI=1S/C29H43N2O6P/c1-2-3-4-5-6-7-8-12-20-31(21-19-28(32)33)29(34)27(30-23-38(35,36)37)22-24-15-17-26(18-16-24)25-13-10-9-11-14-25/h9-11,13-18,27,30H,2-8,12,19-23H2,1H3,(H,32,33)(H2,35,36,37)/p-1