2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-N-(2-methylphenyl)ethanamide

Systemtic Name: 2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-N-(2-methylphenyl)ethanamide Openeye Name: 2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-N-(o-tolyl)acetamide CAS Name: 2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-N-(2-methylphenyl)acetamide IUPAC Name: 2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-N-(2-methylphenyl)acetamide Traditional Name: 2-[4-(4-fluorobenzyl)-1,4-diazepan-1-yl]-N-(o-tolyl)acetamide Formula: C21H26FN3O MolecularWeight: 355.449043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CN2CCCN(CC2)CC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CN2CCCN(CC2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C21H26FN3O/c1-17-5-2-3-6-20(17)23-21(26)16-25-12-4-11-24(13-14-25)15-18-7-9-19(22)10-8-18/h2-3,5-10H,4,11-16H2,1H3,(H,23,26)