6-methoxy-7-(4-methylpiperazin-1-yl)-4-[(4-phenoxyphenyl)amino]quinoline-3-carbonitrile

Systemtic Name: 6-methoxy-7-(4-methylpiperazin-1-yl)-4-[(4-phenoxyphenyl)amino]quinoline-3-carbonitrile Openeye Name: 6-methoxy-7-(4-methylpiperazin-1-yl)-4-(4-phenoxyanilino)quinoline-3-carbonitrile CAS Name: 6-methoxy-7-(4-methyl-1-piperazinyl)-4-(4-phenoxyanilino)-3-quinolinecarbonitrile IUPAC Name: 6-methoxy-7-(4-methylpiperazin-1-yl)-4-(4-phenoxyanilino)quinoline-3-carbonitrile Traditional Name: 6-methoxy-7-(4-methylpiperazino)-4-(4-phenoxyanilino)quinoline-3-carbonitrile Formula: C28H27N5O2 MolecularWeight: 465.54628

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C3C(=C2)N=CC(=C3NC4=CC=C(C=C4)OC5=CC=CC=C5)C#N)OC

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C3C(=C2)N=CC(=C3NC4=CC=C(C=C4)OC5=CC=CC=C5)C#N)OC

InChI

InChI=1S/C28H27N5O2/c1-32-12-14-33(15-13-32)26-17-25-24(16-27(26)34-2)28(20(18-29)19-30-25)31-21-8-10-23(11-9-21)35-22-6-4-3-5-7-22/h3-11,16-17,19H,12-15H2,1-2H3,(H,30,31)