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

Systemtic Name: [5-[4-azanyl-1-(cyclopropylmethyl)benzimidazol-2-yl]furan-2-yl]phosphonic acid Openeye Name: [5-[4-amino-1-(cyclopropylmethyl)benzimidazol-2-yl]-2-furyl]phosphonic acid CAS Name: [5-[4-amino-1-(cyclopropylmethyl)-2-benzimidazolyl]-2-furanyl]phosphonic acid IUPAC Name: [5-[4-amino-1-(cyclopropylmethyl)benzimidazol-2-yl]furan-2-yl]phosphonic acid Traditional Name: [5-[4-amino-1-(cyclopropylmethyl)benzimidazol-2-yl]-2-furyl]phosphonic acid Formula: C15H16N3O4P MolecularWeight: 333.279001

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN2C3=C(C(=CC=C3)N)N=C2C4=CC=C(O4)P(=O)(O)O

Isomeric SMILES

C1CC1CN2C3=C(C(=CC=C3)N)N=C2C4=CC=C(O4)P(=O)(O)O

InChI

InChI=1S/C15H16N3O4P/c16-10-2-1-3-11-14(10)17-15(18(11)8-9-4-5-9)12-6-7-13(22-12)23(19,20)21/h1-3,6-7,9H,4-5,8,16H2,(H2,19,20,21)