(2R)-2-[2-[(4-fluorophenyl)amino]benzimidazol-1-yl]butanoate

Systemtic Name: (2R)-2-[2-[(4-fluorophenyl)amino]benzimidazol-1-yl]butanoate Openeye Name: (2R)-2-[2-(4-fluoroanilino)benzimidazol-1-yl]butanoate CAS Name: (2R)-2-[2-(4-fluoroanilino)-1-benzimidazolyl]butanoate IUPAC Name: (2R)-2-[2-(4-fluoroanilino)benzimidazol-1-yl]butanoate Traditional Name: (2R)-2-[2-(4-fluoroanilino)benzimidazol-1-yl]butyrate Formula: C17H15FN3O2- MolecularWeight: 312.318303

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])N1C2=CC=CC=C2N=C1NC3=CC=C(C=C3)F

Isomeric SMILES

CC[C@H](C(=O)[O-])N1C2=CC=CC=C2N=C1NC3=CC=C(C=C3)F

InChI

InChI=1S/C17H16FN3O2/c1-2-14(16(22)23)21-15-6-4-3-5-13(15)20-17(21)19-12-9-7-11(18)8-10-12/h3-10,14H,2H2,1H3,(H,19,20)(H,22,23)/p-1/t14-/m1/s1