1-[(4-chlorophenyl)-(3-fluoranyl-4-methoxy-phenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(4-chlorophenyl)-(3-fluoranyl-4-methoxy-phenyl)methyl]-1,4-diazepane Openeye Name: 1-[(4-chlorophenyl)-(3-fluoro-4-methoxy-phenyl)methyl]-1,4-diazepane CAS Name: 1-[(4-chlorophenyl)-(3-fluoro-4-methoxyphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(4-chlorophenyl)-(3-fluoro-4-methoxyphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(4-chlorophenyl)-(3-fluoro-4-methoxy-phenyl)methyl]-1,4-diazepane Formula: C19H22ClFN2O MolecularWeight: 348.842183

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22ClFN2O/c1-24-18-8-5-15(13-17(18)21)19(14-3-6-16(20)7-4-14)23-11-2-9-22-10-12-23/h3-8,13,19,22H,2,9-12H2,1H3