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

Systemtic Name: [2-[4-azanyl-1-(3-oxidanylpropyl)benzimidazol-2-yl]furan-3-yl]phosphonic acid Openeye Name: [2-[4-amino-1-(3-hydroxypropyl)benzimidazol-2-yl]-3-furyl]phosphonic acid CAS Name: [2-[4-amino-1-(3-hydroxypropyl)-2-benzimidazolyl]-3-furanyl]phosphonic acid IUPAC Name: [2-[4-amino-1-(3-hydroxypropyl)benzimidazol-2-yl]furan-3-yl]phosphonic acid Traditional Name: [2-[4-amino-1-(3-hydroxypropyl)benzimidazol-2-yl]-3-furyl]phosphonic acid Formula: C14H16N3O5P MolecularWeight: 337.267701

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)N)N=C(N2CCCO)C3=C(C=CO3)P(=O)(O)O

Isomeric SMILES

C1=CC2=C(C(=C1)N)N=C(N2CCCO)C3=C(C=CO3)P(=O)(O)O

InChI

InChI=1S/C14H16N3O5P/c15-9-3-1-4-10-12(9)16-14(17(10)6-2-7-18)13-11(5-8-22-13)23(19,20)21/h1,3-5,8,18H,2,6-7,15H2,(H2,19,20,21)