N-(3-chloranyl-4-fluoranyl-phenyl)azepan-1-amine

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)azepan-1-amine Openeye Name: N-(3-chloro-4-fluoro-phenyl)azepan-1-amine CAS Name: N-(3-chloro-4-fluorophenyl)-1-azepanamine IUPAC Name: N-(3-chloro-4-fluorophenyl)azepan-1-amine Traditional Name: azepan-1-yl-(3-chloro-4-fluoro-phenyl)amine Formula: C12H16ClFN2 MolecularWeight: 242.720243

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

C1CCCN(CC1)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C12H16ClFN2/c13-11-9-10(5-6-12(11)14)15-16-7-3-1-2-4-8-16/h5-6,9,15H,1-4,7-8H2