N-[4-[[3-azanylpropyl-(3-fluorophenyl)carbonyl-amino]methyl]phenyl]morpholine-4-carboxamide

Systemtic Name: N-[4-[[3-azanylpropyl-(3-fluorophenyl)carbonyl-amino]methyl]phenyl]morpholine-4-carboxamide Openeye Name: N-[4-[[3-aminopropyl-(3-fluorobenzoyl)amino]methyl]phenyl]morpholine-4-carboxamide CAS Name: N-[4-[[3-aminopropyl-[(3-fluorophenyl)-oxomethyl]amino]methyl]phenyl]-4-morpholinecarboxamide IUPAC Name: N-[4-[[3-aminopropyl-(3-fluorobenzoyl)amino]methyl]phenyl]morpholine-4-carboxamide Traditional Name: N-[4-[[3-aminopropyl-(3-fluorobenzoyl)amino]methyl]phenyl]morpholine-4-carboxamide Formula: C22H27FN4O3 MolecularWeight: 414.473183

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)NC2=CC=C(C=C2)CN(CCCN)C(=O)C3=CC(=CC=C3)F

Isomeric SMILES

C1COCCN1C(=O)NC2=CC=C(C=C2)CN(CCCN)C(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C22H27FN4O3/c23-19-4-1-3-18(15-19)21(28)27(10-2-9-24)16-17-5-7-20(8-6-17)25-22(29)26-11-13-30-14-12-26/h1,3-8,15H,2,9-14,16,24H2,(H,25,29)