1-(azepan-1-yl)-2-(2-bromanyl-4-phenyl-phenoxy)ethanone

Systemtic Name: 1-(azepan-1-yl)-2-(2-bromanyl-4-phenyl-phenoxy)ethanone Openeye Name: 1-(azepan-1-yl)-2-(2-bromo-4-phenyl-phenoxy)ethanone CAS Name: 1-(1-azepanyl)-2-(2-bromo-4-phenylphenoxy)ethanone IUPAC Name: 1-(azepan-1-yl)-2-(2-bromo-4-phenylphenoxy)ethanone Traditional Name: 1-(azepan-1-yl)-2-(2-bromo-4-phenyl-phenoxy)ethanone Formula: C20H22BrNO2 MolecularWeight: 388.29818

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)COC2=C(C=C(C=C2)C3=CC=CC=C3)Br

Isomeric SMILES

C1CCCN(CC1)C(=O)COC2=C(C=C(C=C2)C3=CC=CC=C3)Br

InChI

InChI=1S/C20H22BrNO2/c21-18-14-17(16-8-4-3-5-9-16)10-11-19(18)24-15-20(23)22-12-6-1-2-7-13-22/h3-5,8-11,14H,1-2,6-7,12-13,15H2