[5-[6-chloranyl-1-(cyclopropylmethyl)-4,5-dimethyl-benzimidazol-2-yl]furan-2-yl]phosphonic acid

Systemtic Name: [5-[6-chloranyl-1-(cyclopropylmethyl)-4,5-dimethyl-benzimidazol-2-yl]furan-2-yl]phosphonic acid Openeye Name: [5-[6-chloro-1-(cyclopropylmethyl)-4,5-dimethyl-benzimidazol-2-yl]-2-furyl]phosphonic acid CAS Name: [5-[6-chloro-1-(cyclopropylmethyl)-4,5-dimethyl-2-benzimidazolyl]-2-furanyl]phosphonic acid IUPAC Name: [5-[6-chloro-1-(cyclopropylmethyl)-4,5-dimethylbenzimidazol-2-yl]furan-2-yl]phosphonic acid Traditional Name: [5-[6-chloro-1-(cyclopropylmethyl)-4,5-dimethyl-benzimidazol-2-yl]-2-furyl]phosphonic acid Formula: C17H18ClN2O4P MolecularWeight: 380.762581

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1C)N=C(N2CC3CC3)C4=CC=C(O4)P(=O)(O)O)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1C)N=C(N2CC3CC3)C4=CC=C(O4)P(=O)(O)O)Cl

InChI

InChI=1S/C17H18ClN2O4P/c1-9-10(2)16-13(7-12(9)18)20(8-11-3-4-11)17(19-16)14-5-6-15(24-14)25(21,22)23/h5-7,11H,3-4,8H2,1-2H3,(H2,21,22,23)