4-butoxy-2-fluoranyl-N-[8-methyl-3-[(4-methylpiperazin-1-yl)methyl]quinolin-7-yl]benzamide

Systemtic Name: 4-butoxy-2-fluoranyl-N-[8-methyl-3-[(4-methylpiperazin-1-yl)methyl]quinolin-7-yl]benzamide Openeye Name: 4-butoxy-2-fluoro-N-[8-methyl-3-[(4-methylpiperazin-1-yl)methyl]-7-quinolyl]benzamide CAS Name: 4-butoxy-2-fluoro-N-[8-methyl-3-[(4-methyl-1-piperazinyl)methyl]-7-quinolinyl]benzamide IUPAC Name: 4-butoxy-2-fluoro-N-[8-methyl-3-[(4-methylpiperazin-1-yl)methyl]quinolin-7-yl]benzamide Traditional Name: 4-butoxy-2-fluoro-N-[8-methyl-3-[(4-methylpiperazino)methyl]-7-quinolyl]benzamide Formula: C27H33FN4O2 MolecularWeight: 464.574923

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=C(C=C1)C(=O)NC2=C(C3=NC=C(C=C3C=C2)CN4CCN(CC4)C)C)F

Isomeric SMILES

CCCCOC1=CC(=C(C=C1)C(=O)NC2=C(C3=NC=C(C=C3C=C2)CN4CCN(CC4)C)C)F

InChI

InChI=1S/C27H33FN4O2/c1-4-5-14-34-22-7-8-23(24(28)16-22)27(33)30-25-9-6-21-15-20(17-29-26(21)19(25)2)18-32-12-10-31(3)11-13-32/h6-9,15-17H,4-5,10-14,18H2,1-3H3,(H,30,33)