3-[(1-methyl-5-phenyl-4-pyridin-4-yl-imidazol-2-yl)methoxy]pentan-3-ylphosphonic acid

Systemtic Name: 3-[(1-methyl-5-phenyl-4-pyridin-4-yl-imidazol-2-yl)methoxy]pentan-3-ylphosphonic acid Openeye Name: [1-ethyl-1-[[1-methyl-5-phenyl-4-(4-pyridyl)imidazol-2-yl]methoxy]propyl]phosphonic acid CAS Name: 3-[(1-methyl-5-phenyl-4-pyridin-4-yl-2-imidazolyl)methoxy]pentan-3-ylphosphonic acid IUPAC Name: 3-[(1-methyl-5-phenyl-4-pyridin-4-ylimidazol-2-yl)methoxy]pentan-3-ylphosphonic acid Traditional Name: [1-ethyl-1-[[1-methyl-5-phenyl-4-(4-pyridyl)imidazol-2-yl]methoxy]propyl]phosphonic acid Formula: C21H26N3O4P MolecularWeight: 415.422601

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(OCC1=NC(=C(N1C)C2=CC=CC=C2)C3=CC=NC=C3)P(=O)(O)O

Isomeric SMILES

CCC(CC)(OCC1=NC(=C(N1C)C2=CC=CC=C2)C3=CC=NC=C3)P(=O)(O)O

InChI

InChI=1S/C21H26N3O4P/c1-4-21(5-2,29(25,26)27)28-15-18-23-19(16-11-13-22-14-12-16)20(24(18)3)17-9-7-6-8-10-17/h6-14H,4-5,15H2,1-3H3,(H2,25,26,27)