2-(1,3-benzodioxol-5-yl)-7-chloranyl-8-methyl-N-(4-methylpiperazin-1-yl)quinoline-4-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-7-chloranyl-8-methyl-N-(4-methylpiperazin-1-yl)quinoline-4-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-7-chloro-8-methyl-N-(4-methylpiperazin-1-yl)quinoline-4-carboxamide CAS Name: 2-(1,3-benzodioxol-5-yl)-7-chloro-8-methyl-N-(4-methyl-1-piperazinyl)-4-quinolinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-7-chloro-8-methyl-N-(4-methylpiperazin-1-yl)quinoline-4-carboxamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-7-chloro-8-methyl-N-(4-methylpiperazino)cinchoninamide Formula: C23H23ClN4O3 MolecularWeight: 438.90672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(C=C2C(=O)NN3CCN(CC3)C)C4=CC5=C(C=C4)OCO5)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(C=C2C(=O)NN3CCN(CC3)C)C4=CC5=C(C=C4)OCO5)Cl

InChI

InChI=1S/C23H23ClN4O3/c1-14-18(24)5-4-16-17(23(29)26-28-9-7-27(2)8-10-28)12-19(25-22(14)16)15-3-6-20-21(11-15)31-13-30-20/h3-6,11-12H,7-10,13H2,1-2H3,(H,26,29)