[4-[[2,6-bis(chloranyl)phenyl]methoxy]-3-methoxy-phenyl]methyl-cyclooctyl-azanium

Systemtic Name: [4-[[2,6-bis(chloranyl)phenyl]methoxy]-3-methoxy-phenyl]methyl-cyclooctyl-azanium Openeye Name: cyclooctyl-[[4-[(2,6-dichlorophenyl)methoxy]-3-methoxy-phenyl]methyl]ammonium CAS Name: cyclooctyl-[[4-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]methyl]ammonium IUPAC Name: cyclooctyl-[[4-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]methyl]azanium Traditional Name: cyclooctyl-[4-(2,6-dichlorobenzyl)oxy-3-methoxy-benzyl]ammonium Formula: C23H30Cl2NO2+ MolecularWeight: 423.3958

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH2+]C2CCCCCCC2)OCC3=C(C=CC=C3Cl)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH2+]C2CCCCCCC2)OCC3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C23H29Cl2NO2/c1-27-23-14-17(15-26-18-8-5-3-2-4-6-9-18)12-13-22(23)28-16-19-20(24)10-7-11-21(19)25/h7,10-14,18,26H,2-6,8-9,15-16H2,1H3/p+1