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

Systemtic Name: 4-butoxy-N-(2,6-diethylphenyl)-2,6-dimethyl-1-oxidanidyl-pyridin-1-ium-3-carboxamide Openeye Name: 4-butoxy-N-(2,6-diethylphenyl)-2,6-dimethyl-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: 4-butoxy-N-(2,6-diethylphenyl)-2,6-dimethyl-1-oxido-3-pyridin-1-iumcarboxamide IUPAC Name: 4-butoxy-N-(2,6-diethylphenyl)-2,6-dimethyl-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: 4-butoxy-N-(2,6-diethylphenyl)-2,6-dimethyl-1-oxido-pyridin-1-ium-3-carboxamide Formula: C22H30N2O3 MolecularWeight: 370.4852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N2O3/c1-6-9-13-27-19-14-15(4)24(26)16(5)20(19)22(25)23-21-17(7-2)11-10-12-18(21)8-3/h10-12,14H,6-9,13H2,1-5H3,(H,23,25)