N-[2-(azepan-1-ylcarbonyl)phenyl]-5-bromanyl-2-phenethyloxy-benzamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-5-bromanyl-2-phenethyloxy-benzamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-5-bromo-2-phenethyloxy-benzamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-5-bromo-2-phenethyloxybenzamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-5-bromo-2-phenethyloxybenzamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-5-bromo-2-phenethyloxy-benzamide Formula: C28H29BrN2O3 MolecularWeight: 521.44546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=C(C=CC(=C3)Br)OCCC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=C(C=CC(=C3)Br)OCCC4=CC=CC=C4

InChI

InChI=1S/C28H29BrN2O3/c29-22-14-15-26(34-19-16-21-10-4-3-5-11-21)24(20-22)27(32)30-25-13-7-6-12-23(25)28(33)31-17-8-1-2-9-18-31/h3-7,10-15,20H,1-2,8-9,16-19H2,(H,30,32)