[4-(azepan-1-yl)-3-fluoranyl-phenyl]-(3-bromanyl-4-methoxy-phenyl)methanone

Systemtic Name: [4-(azepan-1-yl)-3-fluoranyl-phenyl]-(3-bromanyl-4-methoxy-phenyl)methanone Openeye Name: [4-(azepan-1-yl)-3-fluoro-phenyl]-(3-bromo-4-methoxy-phenyl)methanone CAS Name: [4-(1-azepanyl)-3-fluorophenyl]-(3-bromo-4-methoxyphenyl)methanone IUPAC Name: [4-(azepan-1-yl)-3-fluorophenyl]-(3-bromo-4-methoxyphenyl)methanone Traditional Name: [4-(azepan-1-yl)-3-fluoro-phenyl]-(3-bromo-4-methoxy-phenyl)methanone Formula: C20H21BrFNO2 MolecularWeight: 406.288643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C2=CC(=C(C=C2)N3CCCCCC3)F)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)C2=CC(=C(C=C2)N3CCCCCC3)F)Br

InChI

InChI=1S/C20H21BrFNO2/c1-25-19-9-7-14(12-16(19)21)20(24)15-6-8-18(17(22)13-15)23-10-4-2-3-5-11-23/h6-9,12-13H,2-5,10-11H2,1H3