N-(2,6-diethylphenyl)-5,6-dimethyl-4-(2-methylpropoxy)-1-oxidanidyl-2-propyl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-(2,6-diethylphenyl)-5,6-dimethyl-4-(2-methylpropoxy)-1-oxidanidyl-2-propyl-pyridin-1-ium-3-carboxamide Openeye Name: N-(2,6-diethylphenyl)-4-isobutoxy-5,6-dimethyl-1-oxido-2-propyl-pyridin-1-ium-3-carboxamide CAS Name: N-(2,6-diethylphenyl)-5,6-dimethyl-4-(2-methylpropoxy)-1-oxido-2-propyl-3-pyridin-1-iumcarboxamide IUPAC Name: N-(2,6-diethylphenyl)-5,6-dimethyl-4-(2-methylpropoxy)-1-oxido-2-propylpyridin-1-ium-3-carboxamide Traditional Name: N-(2,6-diethylphenyl)-4-isobutoxy-5,6-dimethyl-1-oxido-2-propyl-pyridin-1-ium-3-carboxamide Formula: C25H36N2O3 MolecularWeight: 412.56494

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=[N+](C(=C(C(=C1C(=O)NC2=C(C=CC=C2CC)CC)OCC(C)C)C)C)[O-]

Isomeric SMILES

CCCC1=[N+](C(=C(C(=C1C(=O)NC2=C(C=CC=C2CC)CC)OCC(C)C)C)C)[O-]

InChI

InChI=1S/C25H36N2O3/c1-8-12-21-22(24(30-15-16(4)5)17(6)18(7)27(21)29)25(28)26-23-19(9-2)13-11-14-20(23)10-3/h11,13-14,16H,8-10,12,15H2,1-7H3,(H,26,28)