(3-chloranyl-4,5-diethoxy-phenyl)methyl-cyclooctyl-azanium

Systemtic Name: (3-chloranyl-4,5-diethoxy-phenyl)methyl-cyclooctyl-azanium Openeye Name: (3-chloro-4,5-diethoxy-phenyl)methyl-cyclooctyl-ammonium CAS Name: (3-chloro-4,5-diethoxyphenyl)methyl-cyclooctylammonium IUPAC Name: (3-chloro-4,5-diethoxyphenyl)methyl-cyclooctylazanium Traditional Name: (3-chloro-4,5-diethoxy-benzyl)-cyclooctyl-ammonium Formula: C19H31ClNO2+ MolecularWeight: 340.90794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH2+]C2CCCCCCC2)Cl)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+]C2CCCCCCC2)Cl)OCC

InChI

InChI=1S/C19H30ClNO2/c1-3-22-18-13-15(12-17(20)19(18)23-4-2)14-21-16-10-8-6-5-7-9-11-16/h12-13,16,21H,3-11,14H2,1-2H3/p+1