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

Systemtic Name: N-(2,6-diethylphenyl)-2,6-dimethyl-1-oxidanidyl-4-prop-2-enoxy-pyridin-1-ium-3-carboxamide Openeye Name: 4-allyloxy-N-(2,6-diethylphenyl)-2,6-dimethyl-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: N-(2,6-diethylphenyl)-2,6-dimethyl-1-oxido-4-prop-2-enoxy-3-pyridin-1-iumcarboxamide IUPAC Name: N-(2,6-diethylphenyl)-2,6-dimethyl-1-oxido-4-prop-2-enoxypyridin-1-ium-3-carboxamide Traditional Name: 4-allyloxy-N-(2,6-diethylphenyl)-2,6-dimethyl-1-oxido-pyridin-1-ium-3-carboxamide Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)C2=C([N+](=C(C=C2OCC=C)C)[O-])C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)C2=C([N+](=C(C=C2OCC=C)C)[O-])C

InChI

InChI=1S/C21H26N2O3/c1-6-12-26-18-13-14(4)23(25)15(5)19(18)21(24)22-20-16(7-2)10-9-11-17(20)8-3/h6,9-11,13H,1,7-8,12H2,2-5H3,(H,22,24)