1-[(5-chloranyl-2-methoxy-phenyl)-(3-fluoranyl-4-methoxy-phenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(5-chloranyl-2-methoxy-phenyl)-(3-fluoranyl-4-methoxy-phenyl)methyl]-1,4-diazepane Openeye Name: 1-[(5-chloro-2-methoxy-phenyl)-(3-fluoro-4-methoxy-phenyl)methyl]-1,4-diazepane CAS Name: 1-[(5-chloro-2-methoxyphenyl)-(3-fluoro-4-methoxyphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-chloro-2-methoxyphenyl)-(3-fluoro-4-methoxyphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(5-chloro-2-methoxy-phenyl)-(3-fluoro-4-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)Cl)C(C2=CC(=C(C=C2)OC)F)N3CCCNCC3

Isomeric SMILES

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

InChI

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