N-(3-azanylpropyl)-3-fluoranyl-N-[[3-(2-phenoxyethanoylamino)phenyl]methyl]benzamide

Systemtic Name: N-(3-azanylpropyl)-3-fluoranyl-N-[[3-(2-phenoxyethanoylamino)phenyl]methyl]benzamide Openeye Name: N-(3-aminopropyl)-3-fluoro-N-[[3-[(2-phenoxyacetyl)amino]phenyl]methyl]benzamide CAS Name: N-(3-aminopropyl)-3-fluoro-N-[[3-[(1-oxo-2-phenoxyethyl)amino]phenyl]methyl]benzamide IUPAC Name: N-(3-aminopropyl)-3-fluoro-N-[[3-[(2-phenoxyacetyl)amino]phenyl]methyl]benzamide Traditional Name: N-(3-aminopropyl)-3-fluoro-N-[3-[(2-phenoxyacetyl)amino]benzyl]benzamide Formula: C25H26FN3O3 MolecularWeight: 435.490643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(=O)NC2=CC=CC(=C2)CN(CCCN)C(=O)C3=CC(=CC=C3)F

Isomeric SMILES

C1=CC=C(C=C1)OCC(=O)NC2=CC=CC(=C2)CN(CCCN)C(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C25H26FN3O3/c26-21-9-5-8-20(16-21)25(31)29(14-6-13-27)17-19-7-4-10-22(15-19)28-24(30)18-32-23-11-2-1-3-12-23/h1-5,7-12,15-16H,6,13-14,17-18,27H2,(H,28,30)