[5-[4-azanyl-1-(cyclobutylmethyl)benzimidazol-2-yl]furan-2-yl]phosphonic acid

Systemtic Name: [5-[4-azanyl-1-(cyclobutylmethyl)benzimidazol-2-yl]furan-2-yl]phosphonic acid Openeye Name: [5-[4-amino-1-(cyclobutylmethyl)benzimidazol-2-yl]-2-furyl]phosphonic acid CAS Name: [5-[4-amino-1-(cyclobutylmethyl)-2-benzimidazolyl]-2-furanyl]phosphonic acid IUPAC Name: [5-[4-amino-1-(cyclobutylmethyl)benzimidazol-2-yl]furan-2-yl]phosphonic acid Traditional Name: [5-[4-amino-1-(cyclobutylmethyl)benzimidazol-2-yl]-2-furyl]phosphonic acid Formula: C16H18N3O4P MolecularWeight: 347.305581

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)CN2C3=C(C(=CC=C3)N)N=C2C4=CC=C(O4)P(=O)(O)O

Isomeric SMILES

C1CC(C1)CN2C3=C(C(=CC=C3)N)N=C2C4=CC=C(O4)P(=O)(O)O

InChI

InChI=1S/C16H18N3O4P/c17-11-5-2-6-12-15(11)18-16(19(12)9-10-3-1-4-10)13-7-8-14(23-13)24(20,21)22/h2,5-8,10H,1,3-4,9,17H2,(H2,20,21,22)