[2-[4-azanyl-1-(furan-3-ylmethyl)benzimidazol-2-yl]furan-3-yl]phosphonic acid

Systemtic Name: [2-[4-azanyl-1-(furan-3-ylmethyl)benzimidazol-2-yl]furan-3-yl]phosphonic acid Openeye Name: [2-[4-amino-1-(3-furylmethyl)benzimidazol-2-yl]-3-furyl]phosphonic acid CAS Name: [2-[4-amino-1-(3-furanylmethyl)-2-benzimidazolyl]-3-furanyl]phosphonic acid IUPAC Name: [2-[4-amino-1-(furan-3-ylmethyl)benzimidazol-2-yl]furan-3-yl]phosphonic acid Traditional Name: [2-[4-amino-1-(3-furfuryl)benzimidazol-2-yl]-3-furyl]phosphonic acid Formula: C16H14N3O5P MolecularWeight: 359.273221

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)N)N=C(N2CC3=COC=C3)C4=C(C=CO4)P(=O)(O)O

Isomeric SMILES

C1=CC2=C(C(=C1)N)N=C(N2CC3=COC=C3)C4=C(C=CO4)P(=O)(O)O

InChI

InChI=1S/C16H14N3O5P/c17-11-2-1-3-12-14(11)18-16(19(12)8-10-4-6-23-9-10)15-13(5-7-24-15)25(20,21)22/h1-7,9H,8,17H2,(H2,20,21,22)