N-(3-azanylpropyl)-3-fluoranyl-N-[[4-(2-phenoxyethanoylamino)phenyl]methyl]benzamide

Systemtic Name: N-(3-azanylpropyl)-3-fluoranyl-N-[[4-(2-phenoxyethanoylamino)phenyl]methyl]benzamide Openeye Name: N-(3-aminopropyl)-3-fluoro-N-[[4-[(2-phenoxyacetyl)amino]phenyl]methyl]benzamide CAS Name: N-(3-aminopropyl)-3-fluoro-N-[[4-[(1-oxo-2-phenoxyethyl)amino]phenyl]methyl]benzamide IUPAC Name: N-(3-aminopropyl)-3-fluoro-N-[[4-[(2-phenoxyacetyl)amino]phenyl]methyl]benzamide Traditional Name: N-(3-aminopropyl)-3-fluoro-N-[4-[(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=C(C=C2)CN(CCCN)C(=O)C3=CC(=CC=C3)F

Isomeric SMILES

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

InChI

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