6-[1-chloranyl-4-(methylamino)cyclohexa-2,4-dien-1-yl]oxyhexyl-bis(2-methoxyethyl)-methyl-azanium

Systemtic Name: 6-[1-chloranyl-4-(methylamino)cyclohexa-2,4-dien-1-yl]oxyhexyl-bis(2-methoxyethyl)-methyl-azanium Openeye Name: 6-[1-chloro-4-(methylamino)cyclohexa-2,4-dien-1-yl]oxyhexyl-bis(2-methoxyethyl)-methyl-ammonium CAS Name: 6-[[1-chloro-4-(methylamino)-1-cyclohexa-2,4-dienyl]oxy]hexyl-bis(2-methoxyethyl)-methylammonium IUPAC Name: 6-[1-chloro-4-(methylamino)cyclohexa-2,4-dien-1-yl]oxyhexyl-bis(2-methoxyethyl)-methylazanium Traditional Name: 6-[1-chloro-4-(methylamino)cyclohexa-2,4-dien-1-yl]oxyhexyl-bis(2-methoxyethyl)-methyl-ammonium Formula: C20H38ClN2O3+ MolecularWeight: 389.98032

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CCC(C=C1)(OCCCCCC[N+](C)(CCOC)CCOC)Cl

Isomeric SMILES

CNC1=CCC(C=C1)(OCCCCCC[N+](C)(CCOC)CCOC)Cl

InChI

InChI=1S/C20H38ClN2O3/c1-22-19-9-11-20(21,12-10-19)26-16-8-6-5-7-13-23(2,14-17-24-3)15-18-25-4/h9-11,22H,5-8,12-18H2,1-4H3/q+1