6-butyl-N-(2,6-diethylphenyl)-2-methyl-1-oxidanidyl-4-propoxy-pyridin-1-ium-3-carboxamide

Systemtic Name: 6-butyl-N-(2,6-diethylphenyl)-2-methyl-1-oxidanidyl-4-propoxy-pyridin-1-ium-3-carboxamide Openeye Name: 6-butyl-N-(2,6-diethylphenyl)-2-methyl-1-oxido-4-propoxy-pyridin-1-ium-3-carboxamide CAS Name: 6-butyl-N-(2,6-diethylphenyl)-2-methyl-1-oxido-4-propoxy-3-pyridin-1-iumcarboxamide IUPAC Name: 6-butyl-N-(2,6-diethylphenyl)-2-methyl-1-oxido-4-propoxypyridin-1-ium-3-carboxamide Traditional Name: 6-butyl-N-(2,6-diethylphenyl)-2-methyl-1-oxido-4-propoxy-pyridin-1-ium-3-carboxamide Formula: C24H34N2O3 MolecularWeight: 398.53836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=[N+](C(=C(C(=C1)OCCC)C(=O)NC2=C(C=CC=C2CC)CC)C)[O-]

Isomeric SMILES

CCCCC1=[N+](C(=C(C(=C1)OCCC)C(=O)NC2=C(C=CC=C2CC)CC)C)[O-]

InChI

InChI=1S/C24H34N2O3/c1-6-10-14-20-16-21(29-15-7-2)22(17(5)26(20)28)24(27)25-23-18(8-3)12-11-13-19(23)9-4/h11-13,16H,6-10,14-15H2,1-5H3,(H,25,27)