[5-[6,7-dimethyl-1-(2-methylpropyl)benzimidazol-2-yl]furan-2-yl]phosphonic acid

Systemtic Name: [5-[6,7-dimethyl-1-(2-methylpropyl)benzimidazol-2-yl]furan-2-yl]phosphonic acid Openeye Name: [5-(1-isobutyl-6,7-dimethyl-benzimidazol-2-yl)-2-furyl]phosphonic acid CAS Name: [5-[6,7-dimethyl-1-(2-methylpropyl)-2-benzimidazolyl]-2-furanyl]phosphonic acid IUPAC Name: [5-[6,7-dimethyl-1-(2-methylpropyl)benzimidazol-2-yl]furan-2-yl]phosphonic acid Traditional Name: [5-(1-isobutyl-6,7-dimethyl-benzimidazol-2-yl)-2-furyl]phosphonic acid Formula: C17H21N2O4P MolecularWeight: 348.333401

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)N=C(N2CC(C)C)C3=CC=C(O3)P(=O)(O)O)C

Isomeric SMILES

CC1=C(C2=C(C=C1)N=C(N2CC(C)C)C3=CC=C(O3)P(=O)(O)O)C

InChI

InChI=1S/C17H21N2O4P/c1-10(2)9-19-16-12(4)11(3)5-6-13(16)18-17(19)14-7-8-15(23-14)24(20,21)22/h5-8,10H,9H2,1-4H3,(H2,20,21,22)