3-[[5-(4-methylphenyl)-6-phenyl-pyridin-2-yl]methylamino]propylphosphonic acid

Systemtic Name: 3-[[5-(4-methylphenyl)-6-phenyl-pyridin-2-yl]methylamino]propylphosphonic acid Openeye Name: 3-[[6-phenyl-5-(p-tolyl)-2-pyridyl]methylamino]propylphosphonic acid CAS Name: 3-[[5-(4-methylphenyl)-6-phenyl-2-pyridinyl]methylamino]propylphosphonic acid IUPAC Name: 3-[[5-(4-methylphenyl)-6-phenylpyridin-2-yl]methylamino]propylphosphonic acid Traditional Name: 3-[[6-phenyl-5-(p-tolyl)-2-pyridyl]methylamino]propylphosphonic acid Formula: C22H25N2O3P MolecularWeight: 396.419261

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N=C(C=C2)CNCCCP(=O)(O)O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N=C(C=C2)CNCCCP(=O)(O)O)C3=CC=CC=C3

InChI

InChI=1S/C22H25N2O3P/c1-17-8-10-18(11-9-17)21-13-12-20(16-23-14-5-15-28(25,26)27)24-22(21)19-6-3-2-4-7-19/h2-4,6-13,23H,5,14-16H2,1H3,(H2,25,26,27)