N-[[3-(aminomethyl)phenyl]methyl]-N-[(4-benzamidophenyl)methyl]-3-fluoranyl-benzamide

Systemtic Name: N-[[3-(aminomethyl)phenyl]methyl]-N-[(4-benzamidophenyl)methyl]-3-fluoranyl-benzamide Openeye Name: N-[[3-(aminomethyl)phenyl]methyl]-N-[(4-benzamidophenyl)methyl]-3-fluoro-benzamide CAS Name: N-[[3-(aminomethyl)phenyl]methyl]-N-[(4-benzamidophenyl)methyl]-3-fluorobenzamide IUPAC Name: N-[[3-(aminomethyl)phenyl]methyl]-N-[(4-benzamidophenyl)methyl]-3-fluorobenzamide Traditional Name: N-[3-(aminomethyl)benzyl]-N-(4-benzamidobenzyl)-3-fluoro-benzamide Formula: C29H26FN3O2 MolecularWeight: 467.534043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)CN(CC3=CC=CC(=C3)CN)C(=O)C4=CC(=CC=C4)F

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)CN(CC3=CC=CC(=C3)CN)C(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C29H26FN3O2/c30-26-11-5-10-25(17-26)29(35)33(20-23-7-4-6-22(16-23)18-31)19-21-12-14-27(15-13-21)32-28(34)24-8-2-1-3-9-24/h1-17H,18-20,31H2,(H,32,34)