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

Systemtic Name: N-(2,6-diethylphenyl)-2,6-dimethyl-4-(2-methylpropoxy)-1-oxidanidyl-pyridin-1-ium-3-carboxamide Openeye Name: N-(2,6-diethylphenyl)-4-isobutoxy-2,6-dimethyl-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: N-(2,6-diethylphenyl)-2,6-dimethyl-4-(2-methylpropoxy)-1-oxido-3-pyridin-1-iumcarboxamide IUPAC Name: N-(2,6-diethylphenyl)-2,6-dimethyl-4-(2-methylpropoxy)-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: N-(2,6-diethylphenyl)-4-isobutoxy-2,6-dimethyl-1-oxido-pyridin-1-ium-3-carboxamide Formula: C22H30N2O3 MolecularWeight: 370.4852

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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)C)[O-])C

Isomeric SMILES

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

InChI

InChI=1S/C22H30N2O3/c1-7-17-10-9-11-18(8-2)21(17)23-22(25)20-16(6)24(26)15(5)12-19(20)27-13-14(3)4/h9-12,14H,7-8,13H2,1-6H3,(H,23,25)