3-[[5-(4-ethylphenyl)-6-phenyl-pyridin-2-yl]-methyl-amino]propylphosphonic acid

Systemtic Name: 3-[[5-(4-ethylphenyl)-6-phenyl-pyridin-2-yl]-methyl-amino]propylphosphonic acid Openeye Name: 3-[[5-(4-ethylphenyl)-6-phenyl-2-pyridyl]-methyl-amino]propylphosphonic acid CAS Name: 3-[[5-(4-ethylphenyl)-6-phenyl-2-pyridinyl]-methylamino]propylphosphonic acid IUPAC Name: 3-[[5-(4-ethylphenyl)-6-phenylpyridin-2-yl]-methylamino]propylphosphonic acid Traditional Name: 3-[[5-(4-ethylphenyl)-6-phenyl-2-pyridyl]-methyl-amino]propylphosphonic acid Formula: C23H27N2O3P MolecularWeight: 410.445841

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(N=C(C=C2)N(C)CCCP(=O)(O)O)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(N=C(C=C2)N(C)CCCP(=O)(O)O)C3=CC=CC=C3

InChI

InChI=1S/C23H27N2O3P/c1-3-18-10-12-19(13-11-18)21-14-15-22(25(2)16-7-17-29(26,27)28)24-23(21)20-8-5-4-6-9-20/h4-6,8-15H,3,7,16-17H2,1-2H3,(H2,26,27,28)