[5-(3-chloranyl-4-fluoranyl-phenyl)furan-2-yl]methyl-cycloheptyl-azanium

Systemtic Name: [5-(3-chloranyl-4-fluoranyl-phenyl)furan-2-yl]methyl-cycloheptyl-azanium Openeye Name: [5-(3-chloro-4-fluoro-phenyl)-2-furyl]methyl-cycloheptyl-ammonium CAS Name: [5-(3-chloro-4-fluorophenyl)-2-furanyl]methyl-cycloheptylammonium IUPAC Name: [5-(3-chloro-4-fluorophenyl)furan-2-yl]methyl-cycloheptylazanium Traditional Name: [5-(3-chloro-4-fluoro-phenyl)-2-furyl]methyl-cycloheptyl-ammonium Formula: C18H22ClFNO+ MolecularWeight: 322.824783

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)[NH2+]CC2=CC=C(O2)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CCCC(CC1)[NH2+]CC2=CC=C(O2)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C18H21ClFNO/c19-16-11-13(7-9-17(16)20)18-10-8-15(22-18)12-21-14-5-3-1-2-4-6-14/h7-11,14,21H,1-6,12H2/p+1