4-butoxy-N-(4-chloranyl-2,6-diethyl-phenyl)-2,6-dimethyl-1-oxidanidyl-pyridin-1-ium-3-carboxamide

Systemtic Name: 4-butoxy-N-(4-chloranyl-2,6-diethyl-phenyl)-2,6-dimethyl-1-oxidanidyl-pyridin-1-ium-3-carboxamide Openeye Name: 4-butoxy-N-(4-chloro-2,6-diethyl-phenyl)-2,6-dimethyl-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: 4-butoxy-N-(4-chloro-2,6-diethylphenyl)-2,6-dimethyl-1-oxido-3-pyridin-1-iumcarboxamide IUPAC Name: 4-butoxy-N-(4-chloro-2,6-diethylphenyl)-2,6-dimethyl-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: 4-butoxy-N-(4-chloro-2,6-diethyl-phenyl)-2,6-dimethyl-1-oxido-pyridin-1-ium-3-carboxamide Formula: C22H29ClN2O3 MolecularWeight: 404.93026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=[N+](C(=C1C(=O)NC2=C(C=C(C=C2CC)Cl)CC)C)[O-])C

Isomeric SMILES

CCCCOC1=CC(=[N+](C(=C1C(=O)NC2=C(C=C(C=C2CC)Cl)CC)C)[O-])C

InChI

InChI=1S/C22H29ClN2O3/c1-6-9-10-28-19-11-14(4)25(27)15(5)20(19)22(26)24-21-16(7-2)12-18(23)13-17(21)8-3/h11-13H,6-10H2,1-5H3,(H,24,26)