3-ethoxy-N-[[4-fluoranyl-3-[3-[(3-methylpiperazin-1-yl)methyl]phenyl]phenyl]methyl]benzamide

Systemtic Name: 3-ethoxy-N-[[4-fluoranyl-3-[3-[(3-methylpiperazin-1-yl)methyl]phenyl]phenyl]methyl]benzamide Openeye Name: 3-ethoxy-N-[[4-fluoro-3-[3-[(3-methylpiperazin-1-yl)methyl]phenyl]phenyl]methyl]benzamide CAS Name: 3-ethoxy-N-[[4-fluoro-3-[3-[(3-methyl-1-piperazinyl)methyl]phenyl]phenyl]methyl]benzamide IUPAC Name: 3-ethoxy-N-[[4-fluoro-3-[3-[(3-methylpiperazin-1-yl)methyl]phenyl]phenyl]methyl]benzamide Traditional Name: 3-ethoxy-N-[4-fluoro-3-[3-[(3-methylpiperazino)methyl]phenyl]benzyl]benzamide Formula: C28H32FN3O2 MolecularWeight: 461.570983

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(=O)NCC2=CC(=C(C=C2)F)C3=CC(=CC=C3)CN4CCNC(C4)C

Isomeric SMILES

CCOC1=CC=CC(=C1)C(=O)NCC2=CC(=C(C=C2)F)C3=CC(=CC=C3)CN4CCNC(C4)C

InChI

InChI=1S/C28H32FN3O2/c1-3-34-25-9-5-8-24(16-25)28(33)31-17-21-10-11-27(29)26(15-21)23-7-4-6-22(14-23)19-32-13-12-30-20(2)18-32/h4-11,14-16,20,30H,3,12-13,17-19H2,1-2H3,(H,31,33)