N-[3-[[3-azanylpropyl-(4-methoxyphenyl)carbonyl-amino]methyl]phenyl]-3-fluoranyl-benzamide

Systemtic Name: N-[3-[[3-azanylpropyl-(4-methoxyphenyl)carbonyl-amino]methyl]phenyl]-3-fluoranyl-benzamide Openeye Name: N-[3-[[3-aminopropyl-(4-methoxybenzoyl)amino]methyl]phenyl]-3-fluoro-benzamide CAS Name: N-[3-[[3-aminopropyl-[(4-methoxyphenyl)-oxomethyl]amino]methyl]phenyl]-3-fluorobenzamide IUPAC Name: N-[3-[[3-aminopropyl-(4-methoxybenzoyl)amino]methyl]phenyl]-3-fluorobenzamide Traditional Name: N-[3-[[3-aminopropyl(p-anisoyl)amino]methyl]phenyl]-3-fluoro-benzamide Formula: C25H26FN3O3 MolecularWeight: 435.490643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N(CCCN)CC2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N(CCCN)CC2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C25H26FN3O3/c1-32-23-11-9-19(10-12-23)25(31)29(14-4-13-27)17-18-5-2-8-22(15-18)28-24(30)20-6-3-7-21(26)16-20/h2-3,5-12,15-16H,4,13-14,17,27H2,1H3,(H,28,30)