3-[2-[(4-fluorophenyl)amino]benzimidazol-1-yl]propanoate

Systemtic Name: 3-[2-[(4-fluorophenyl)amino]benzimidazol-1-yl]propanoate Openeye Name: 3-[2-(4-fluoroanilino)benzimidazol-1-yl]propanoate CAS Name: 3-[2-(4-fluoroanilino)-1-benzimidazolyl]propanoate IUPAC Name: 3-[2-(4-fluoroanilino)benzimidazol-1-yl]propanoate Traditional Name: 3-[2-(4-fluoroanilino)benzimidazol-1-yl]propionate Formula: C16H13FN3O2- MolecularWeight: 298.291723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2CCC(=O)[O-])NC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2CCC(=O)[O-])NC3=CC=C(C=C3)F

InChI

InChI=1S/C16H14FN3O2/c17-11-5-7-12(8-6-11)18-16-19-13-3-1-2-4-14(13)20(16)10-9-15(21)22/h1-8H,9-10H2,(H,18,19)(H,21,22)/p-1