N-(2,3-dimethylphenyl)-2-ethyl-6-methyl-4-(2-methylpropoxy)-1-oxidanidyl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-ethyl-6-methyl-4-(2-methylpropoxy)-1-oxidanidyl-pyridin-1-ium-3-carboxamide Openeye Name: N-(2,3-dimethylphenyl)-2-ethyl-4-isobutoxy-6-methyl-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: N-(2,3-dimethylphenyl)-2-ethyl-6-methyl-4-(2-methylpropoxy)-1-oxido-3-pyridin-1-iumcarboxamide IUPAC Name: N-(2,3-dimethylphenyl)-2-ethyl-6-methyl-4-(2-methylpropoxy)-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: N-(2,3-dimethylphenyl)-2-ethyl-4-isobutoxy-6-methyl-1-oxido-pyridin-1-ium-3-carboxamide Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=[N+]1[O-])C)OCC(C)C)C(=O)NC2=CC=CC(=C2C)C

Isomeric SMILES

CCC1=C(C(=CC(=[N+]1[O-])C)OCC(C)C)C(=O)NC2=CC=CC(=C2C)C

InChI

InChI=1S/C21H28N2O3/c1-7-18-20(19(26-12-13(2)3)11-15(5)23(18)25)21(24)22-17-10-8-9-14(4)16(17)6/h8-11,13H,7,12H2,1-6H3,(H,22,24)