6-chloranyl-3-(6-morpholin-4-yl-1H-benzimidazol-2-yl)-1-(octan-3-ylamino)quinolin-2-one

Systemtic Name: 6-chloranyl-3-(6-morpholin-4-yl-1H-benzimidazol-2-yl)-1-(octan-3-ylamino)quinolin-2-one Openeye Name: 6-chloro-1-(1-ethylhexylamino)-3-(6-morpholino-1H-benzimidazol-2-yl)quinolin-2-one CAS Name: 6-chloro-3-[6-(4-morpholinyl)-1H-benzimidazol-2-yl]-1-(octan-3-ylamino)-2-quinolinone IUPAC Name: 6-chloro-3-(6-morpholin-4-yl-1H-benzimidazol-2-yl)-1-(octan-3-ylamino)quinolin-2-one Traditional Name: 6-chloro-1-(1-ethylhexylamino)-3-(6-morpholino-1H-benzimidazol-2-yl)carbostyril Formula: C28H34ClN5O2 MolecularWeight: 508.05486

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)NN1C2=C(C=C(C=C2)Cl)C=C(C1=O)C3=NC4=C(N3)C=C(C=C4)N5CCOCC5

Isomeric SMILES

CCCCCC(CC)NN1C2=C(C=C(C=C2)Cl)C=C(C1=O)C3=NC4=C(N3)C=C(C=C4)N5CCOCC5

InChI

InChI=1S/C28H34ClN5O2/c1-3-5-6-7-21(4-2)32-34-26-11-8-20(29)16-19(26)17-23(28(34)35)27-30-24-10-9-22(18-25(24)31-27)33-12-14-36-15-13-33/h8-11,16-18,21,32H,3-7,12-15H2,1-2H3,(H,30,31)