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

Systemtic Name: 4-butoxy-N-(2,6-diethylphenyl)-6-methyl-1-oxidanidyl-2-phenyl-pyridin-1-ium-3-carboxamide Openeye Name: 4-butoxy-N-(2,6-diethylphenyl)-6-methyl-1-oxido-2-phenyl-pyridin-1-ium-3-carboxamide CAS Name: 4-butoxy-N-(2,6-diethylphenyl)-6-methyl-1-oxido-2-phenyl-3-pyridin-1-iumcarboxamide IUPAC Name: 4-butoxy-N-(2,6-diethylphenyl)-6-methyl-1-oxido-2-phenylpyridin-1-ium-3-carboxamide Traditional Name: 4-butoxy-N-(2,6-diethylphenyl)-6-methyl-1-oxido-2-phenyl-pyridin-1-ium-3-carboxamide Formula: C27H32N2O3 MolecularWeight: 432.55458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=[N+](C(=C1C(=O)NC2=C(C=CC=C2CC)CC)C3=CC=CC=C3)[O-])C

Isomeric SMILES

CCCCOC1=CC(=[N+](C(=C1C(=O)NC2=C(C=CC=C2CC)CC)C3=CC=CC=C3)[O-])C

InChI

InChI=1S/C27H32N2O3/c1-5-8-17-32-23-18-19(4)29(31)26(22-13-10-9-11-14-22)24(23)27(30)28-25-20(6-2)15-12-16-21(25)7-3/h9-16,18H,5-8,17H2,1-4H3,(H,28,30)