3-(1H-benzimidazol-2-yl)-7-(2-dimethylaminoethylamino)-6-fluoranyl-1-(octan-3-ylamino)quinolin-2-one

Systemtic Name: 3-(1H-benzimidazol-2-yl)-7-(2-dimethylaminoethylamino)-6-fluoranyl-1-(octan-3-ylamino)quinolin-2-one Openeye Name: 3-(1H-benzimidazol-2-yl)-7-(2-dimethylaminoethylamino)-1-(1-ethylhexylamino)-6-fluoro-quinolin-2-one CAS Name: 3-(1H-benzimidazol-2-yl)-7-(2-dimethylaminoethylamino)-6-fluoro-1-(octan-3-ylamino)-2-quinolinone IUPAC Name: 3-(1H-benzimidazol-2-yl)-7-(2-dimethylaminoethylamino)-6-fluoro-1-(octan-3-ylamino)quinolin-2-one Traditional Name: 3-(1H-benzimidazol-2-yl)-7-(2-dimethylaminoethylamino)-1-(1-ethylhexylamino)-6-fluoro-carbostyril Formula: C28H37FN6O MolecularWeight: 492.631383

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)NN1C2=CC(=C(C=C2C=C(C1=O)C3=NC4=CC=CC=C4N3)F)NCCN(C)C

Isomeric SMILES

CCCCCC(CC)NN1C2=CC(=C(C=C2C=C(C1=O)C3=NC4=CC=CC=C4N3)F)NCCN(C)C

InChI

InChI=1S/C28H37FN6O/c1-5-7-8-11-20(6-2)33-35-26-18-25(30-14-15-34(3)4)22(29)17-19(26)16-21(28(35)36)27-31-23-12-9-10-13-24(23)32-27/h9-10,12-13,16-18,20,30,33H,5-8,11,14-15H2,1-4H3,(H,31,32)