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

Systemtic Name: N-(2,6-diethylphenyl)-2,6-diethyl-1-oxidanidyl-4-prop-2-enoxy-pyridin-1-ium-3-carboxamide Openeye Name: 4-allyloxy-N-(2,6-diethylphenyl)-2,6-diethyl-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: N-(2,6-diethylphenyl)-2,6-diethyl-1-oxido-4-prop-2-enoxy-3-pyridin-1-iumcarboxamide IUPAC Name: N-(2,6-diethylphenyl)-2,6-diethyl-1-oxido-4-prop-2-enoxypyridin-1-ium-3-carboxamide Traditional Name: 4-allyloxy-N-(2,6-diethylphenyl)-2,6-diethyl-1-oxido-pyridin-1-ium-3-carboxamide Formula: C23H30N2O3 MolecularWeight: 382.4959

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N2O3/c1-6-14-28-20-15-18(9-4)25(27)19(10-5)21(20)23(26)24-22-16(7-2)12-11-13-17(22)8-3/h6,11-13,15H,1,7-10,14H2,2-5H3,(H,24,26)