1-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-4-(furan-2-ylmethyl)-1,4-diazepane

Systemtic Name: 1-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-4-(furan-2-ylmethyl)-1,4-diazepane Openeye Name: 1-[(3-chloro-4-fluoro-phenyl)methyl]-4-(2-furylmethyl)-1,4-diazepane CAS Name: 1-[(3-chloro-4-fluorophenyl)methyl]-4-(2-furanylmethyl)-1,4-diazepane IUPAC Name: 1-[(3-chloro-4-fluorophenyl)methyl]-4-(furan-2-ylmethyl)-1,4-diazepane Traditional Name: 1-(3-chloro-4-fluoro-benzyl)-4-(2-furfuryl)-1,4-diazepane Formula: C17H20ClFN2O MolecularWeight: 322.804903

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)CC2=CC=CO2)CC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CN(CCN(C1)CC2=CC=CO2)CC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C17H20ClFN2O/c18-16-11-14(4-5-17(16)19)12-20-6-2-7-21(9-8-20)13-15-3-1-10-22-15/h1,3-5,10-11H,2,6-9,12-13H2