[2-[4-azanyl-1-[(E)-2-methylbut-2-enyl]benzimidazol-2-yl]furan-3-yl]phosphonic acid

Systemtic Name: [2-[4-azanyl-1-[(E)-2-methylbut-2-enyl]benzimidazol-2-yl]furan-3-yl]phosphonic acid Openeye Name: [2-[4-amino-1-[(E)-2-methylbut-2-enyl]benzimidazol-2-yl]-3-furyl]phosphonic acid CAS Name: [2-[4-amino-1-[(E)-2-methylbut-2-enyl]-2-benzimidazolyl]-3-furanyl]phosphonic acid IUPAC Name: [2-[4-amino-1-[(E)-2-methylbut-2-enyl]benzimidazol-2-yl]furan-3-yl]phosphonic acid Traditional Name: [2-[4-amino-1-[(E)-2-methylbut-2-enyl]benzimidazol-2-yl]-3-furyl]phosphonic acid Formula: C16H18N3O4P MolecularWeight: 347.305581

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)CN1C2=C(C(=CC=C2)N)N=C1C3=C(C=CO3)P(=O)(O)O

Isomeric SMILES

C/C=C(\C)/CN1C2=C(C(=CC=C2)N)N=C1C3=C(C=CO3)P(=O)(O)O

InChI

InChI=1S/C16H18N3O4P/c1-3-10(2)9-19-12-6-4-5-11(17)14(12)18-16(19)15-13(7-8-23-15)24(20,21)22/h3-8H,9,17H2,1-2H3,(H2,20,21,22)/b10-3+