azepan-1-yl-(5-bromanyl-2-phenethyloxy-phenyl)methanone

Systemtic Name: azepan-1-yl-(5-bromanyl-2-phenethyloxy-phenyl)methanone Openeye Name: azepan-1-yl-(5-bromo-2-phenethyloxy-phenyl)methanone CAS Name: 1-azepanyl-(5-bromo-2-phenethyloxyphenyl)methanone IUPAC Name: azepan-1-yl-(5-bromo-2-phenethyloxyphenyl)methanone Traditional Name: azepan-1-yl-(5-bromo-2-phenethyloxy-phenyl)methanone Formula: C21H24BrNO2 MolecularWeight: 402.32476

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3

InChI

InChI=1S/C21H24BrNO2/c22-18-10-11-20(25-15-12-17-8-4-3-5-9-17)19(16-18)21(24)23-13-6-1-2-7-14-23/h3-5,8-11,16H,1-2,6-7,12-15H2