[3-(6-methyl-1H-benzimidazol-5-yl)-1-oxidanyl-1-phosphono-propyl]phosphonic acid

Systemtic Name: [3-(6-methyl-1H-benzimidazol-5-yl)-1-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [1-hydroxy-3-(6-methyl-1H-benzimidazol-5-yl)-1-phosphono-propyl]phosphonic acid CAS Name: [1-hydroxy-3-(6-methyl-1H-benzimidazol-5-yl)-1-phosphonopropyl]phosphonic acid IUPAC Name: [1-hydroxy-3-(6-methyl-1H-benzimidazol-5-yl)-1-phosphonopropyl]phosphonic acid Traditional Name: [1-hydroxy-3-(6-methyl-1H-benzimidazol-5-yl)-1-phosphono-propyl]phosphonic acid Formula: C11H16N2O7P2 MolecularWeight: 350.201462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1CCC(O)(P(=O)(O)O)P(=O)(O)O)N=CN2

Isomeric SMILES

CC1=CC2=C(C=C1CCC(O)(P(=O)(O)O)P(=O)(O)O)N=CN2

InChI

InChI=1S/C11H16N2O7P2/c1-7-4-9-10(13-6-12-9)5-8(7)2-3-11(14,21(15,16)17)22(18,19)20/h4-6,14H,2-3H2,1H3,(H,12,13)(H2,15,16,17)(H2,18,19,20)