1-[(5-chloranyl-2-methoxy-phenyl)-(5-fluoranyl-2-methoxy-phenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(5-chloranyl-2-methoxy-phenyl)-(5-fluoranyl-2-methoxy-phenyl)methyl]-1,4-diazepane Openeye Name: 1-[(5-chloro-2-methoxy-phenyl)-(5-fluoro-2-methoxy-phenyl)methyl]-1,4-diazepane CAS Name: 1-[(5-chloro-2-methoxyphenyl)-(5-fluoro-2-methoxyphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-chloro-2-methoxyphenyl)-(5-fluoro-2-methoxyphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(5-chloro-2-methoxy-phenyl)-(5-fluoro-2-methoxy-phenyl)methyl]-1,4-diazepane Formula: C20H24ClFN2O2 MolecularWeight: 378.868163

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)C(C2=C(C=CC(=C2)Cl)OC)N3CCCNCC3

Isomeric SMILES

COC1=C(C=C(C=C1)F)C(C2=C(C=CC(=C2)Cl)OC)N3CCCNCC3

InChI

InChI=1S/C20H24ClFN2O2/c1-25-18-6-4-14(21)12-16(18)20(24-10-3-8-23-9-11-24)17-13-15(22)5-7-19(17)26-2/h4-7,12-13,20,23H,3,8-11H2,1-2H3