1-[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1,4-diazepan-1-yl]hex-5-en-2-ol

Systemtic Name: 1-[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1,4-diazepan-1-yl]hex-5-en-2-ol Openeye Name: 1-[4-[(2-chloro-6-fluoro-phenyl)methyl]-1,4-diazepan-1-yl]hex-5-en-2-ol CAS Name: 1-[4-[(2-chloro-6-fluorophenyl)methyl]-1,4-diazepan-1-yl]-5-hexen-2-ol IUPAC Name: 1-[4-[(2-chloro-6-fluorophenyl)methyl]-1,4-diazepan-1-yl]hex-5-en-2-ol Traditional Name: 1-[4-(2-chloro-6-fluoro-benzyl)-1,4-diazepan-1-yl]hex-5-en-2-ol Formula: C18H26ClFN2O MolecularWeight: 340.863243

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCC(CN1CCCN(CC1)CC2=C(C=CC=C2Cl)F)O

Isomeric SMILES

C=CCCC(CN1CCCN(CC1)CC2=C(C=CC=C2Cl)F)O

InChI

InChI=1S/C18H26ClFN2O/c1-2-3-6-15(23)13-21-9-5-10-22(12-11-21)14-16-17(19)7-4-8-18(16)20/h2,4,7-8,15,23H,1,3,5-6,9-14H2