4-[[(2Z)-2-(4-azanyl-5-fluoranyl-2-oxidanylidene-quinolin-3-ylidene)-1,3-dihydrobenzimidazol-5-yl]methylamino]-3-oxidanyl-butanoic acid

Systemtic Name: 4-[[(2Z)-2-(4-azanyl-5-fluoranyl-2-oxidanylidene-quinolin-3-ylidene)-1,3-dihydrobenzimidazol-5-yl]methylamino]-3-oxidanyl-butanoic acid Openeye Name: 4-[[(2Z)-2-(4-amino-5-fluoro-2-oxo-3-quinolylidene)-1,3-dihydrobenzimidazol-5-yl]methylamino]-3-hydroxy-butanoic acid CAS Name: 4-[[(2Z)-2-(4-amino-5-fluoro-2-oxo-3-quinolinylidene)-1,3-dihydrobenzimidazol-5-yl]methylamino]-3-hydroxybutanoic acid IUPAC Name: 4-[[(2Z)-2-(4-amino-5-fluoro-2-oxoquinolin-3-ylidene)-1,3-dihydrobenzimidazol-5-yl]methylamino]-3-hydroxybutanoic acid Traditional Name: 4-[[(2Z)-2-(4-amino-5-fluoro-2-keto-3-quinolylidene)-1,3-dihydrobenzimidazol-5-yl]methylamino]-3-hydroxy-butyric acid Formula: C21H20FN5O4 MolecularWeight: 425.413003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC(=O)C(=C3NC4=C(N3)C=C(C=C4)CNCC(CC(=O)O)O)C(=C2C(=C1)F)N

Isomeric SMILES

C1=CC2=NC(=O)/C(=C\3/NC4=C(N3)C=C(C=C4)CNCC(CC(=O)O)O)/C(=C2C(=C1)F)N

InChI

InChI=1S/C21H20FN5O4/c22-12-2-1-3-14-17(12)19(23)18(21(31)27-14)20-25-13-5-4-10(6-15(13)26-20)8-24-9-11(28)7-16(29)30/h1-6,11,24-26,28H,7-9,23H2,(H,29,30)/b20-18-