[5-[7-(hydroxymethyl)-1-(2-methylpropyl)benzimidazol-2-yl]furan-2-yl]phosphonic acid

Systemtic Name: [5-[7-(hydroxymethyl)-1-(2-methylpropyl)benzimidazol-2-yl]furan-2-yl]phosphonic acid Openeye Name: [5-[7-(hydroxymethyl)-1-isobutyl-benzimidazol-2-yl]-2-furyl]phosphonic acid CAS Name: [5-[7-(hydroxymethyl)-1-(2-methylpropyl)-2-benzimidazolyl]-2-furanyl]phosphonic acid IUPAC Name: [5-[7-(hydroxymethyl)-1-(2-methylpropyl)benzimidazol-2-yl]furan-2-yl]phosphonic acid Traditional Name: [5-(1-isobutyl-7-methylol-benzimidazol-2-yl)-2-furyl]phosphonic acid Formula: C16H19N2O5P MolecularWeight: 350.306221

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C=CC=C2N=C1C3=CC=C(O3)P(=O)(O)O)CO

Isomeric SMILES

CC(C)CN1C2=C(C=CC=C2N=C1C3=CC=C(O3)P(=O)(O)O)CO

InChI

InChI=1S/C16H19N2O5P/c1-10(2)8-18-15-11(9-19)4-3-5-12(15)17-16(18)13-6-7-14(23-13)24(20,21)22/h3-7,10,19H,8-9H2,1-2H3,(H2,20,21,22)