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

Systemtic Name: 3-cyclohexyl-3-[cyclohexylmethyl-[[4-(phosphonomethyl)phenyl]methyl]amino]propanoic acid Openeye Name: 3-cyclohexyl-3-[cyclohexylmethyl-[[4-(phosphonomethyl)phenyl]methyl]amino]propanoic acid CAS Name: 3-cyclohexyl-3-[cyclohexylmethyl-[[4-(phosphonomethyl)phenyl]methyl]amino]propanoic acid IUPAC Name: 3-cyclohexyl-3-[cyclohexylmethyl-[[4-(phosphonomethyl)phenyl]methyl]amino]propanoic acid Traditional Name: 3-cyclohexyl-3-[cyclohexylmethyl-[4-(phosphonomethyl)benzyl]amino]propionic acid Formula: C24H38NO5P MolecularWeight: 451.535981

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN(CC2=CC=C(C=C2)CP(=O)(O)O)C(CC(=O)O)C3CCCCC3

Isomeric SMILES

C1CCC(CC1)CN(CC2=CC=C(C=C2)CP(=O)(O)O)C(CC(=O)O)C3CCCCC3

InChI

InChI=1S/C24H38NO5P/c26-24(27)15-23(22-9-5-2-6-10-22)25(16-19-7-3-1-4-8-19)17-20-11-13-21(14-12-20)18-31(28,29)30/h11-14,19,22-23H,1-10,15-18H2,(H,26,27)(H2,28,29,30)