[4-[(2-chloranyl-4-fluoranyl-phenyl)methoxy]-3-methoxy-phenyl]methyl-cyclohexyl-azanium

Systemtic Name: [4-[(2-chloranyl-4-fluoranyl-phenyl)methoxy]-3-methoxy-phenyl]methyl-cyclohexyl-azanium Openeye Name: [4-[(2-chloro-4-fluoro-phenyl)methoxy]-3-methoxy-phenyl]methyl-cyclohexyl-ammonium CAS Name: [4-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl-cyclohexylammonium IUPAC Name: [4-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl-cyclohexylazanium Traditional Name: [4-(2-chloro-4-fluoro-benzyl)oxy-3-methoxy-benzyl]-cyclohexyl-ammonium Formula: C21H26ClFNO2+ MolecularWeight: 378.888043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH2+]C2CCCCC2)OCC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH2+]C2CCCCC2)OCC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C21H25ClFNO2/c1-25-21-11-15(13-24-18-5-3-2-4-6-18)7-10-20(21)26-14-16-8-9-17(23)12-19(16)22/h7-12,18,24H,2-6,13-14H2,1H3/p+1