3-cyclohexyl-3-[(3-methoxyphenyl)methyl-[[4-(phosphonomethyl)phenyl]methyl]amino]propanoic acid

Systemtic Name: 3-cyclohexyl-3-[(3-methoxyphenyl)methyl-[[4-(phosphonomethyl)phenyl]methyl]amino]propanoic acid Openeye Name: 3-cyclohexyl-3-[(3-methoxyphenyl)methyl-[[4-(phosphonomethyl)phenyl]methyl]amino]propanoic acid CAS Name: 3-cyclohexyl-3-[(3-methoxyphenyl)methyl-[[4-(phosphonomethyl)phenyl]methyl]amino]propanoic acid IUPAC Name: 3-cyclohexyl-3-[(3-methoxyphenyl)methyl-[[4-(phosphonomethyl)phenyl]methyl]amino]propanoic acid Traditional Name: 3-cyclohexyl-3-[m-anisyl-[4-(phosphonomethyl)benzyl]amino]propionic acid Formula: C25H34NO6P MolecularWeight: 475.514321

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN(CC2=CC=C(C=C2)CP(=O)(O)O)C(CC(=O)O)C3CCCCC3

Isomeric SMILES

COC1=CC=CC(=C1)CN(CC2=CC=C(C=C2)CP(=O)(O)O)C(CC(=O)O)C3CCCCC3

InChI

InChI=1S/C25H34NO6P/c1-32-23-9-5-6-21(14-23)17-26(24(15-25(27)28)22-7-3-2-4-8-22)16-19-10-12-20(13-11-19)18-33(29,30)31/h5-6,9-14,22,24H,2-4,7-8,15-18H2,1H3,(H,27,28)(H2,29,30,31)