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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=CC(=[N+]1[O-])C)OCC(C)C)C(=O)NC2=CC=CC(=C2C)C

Isomeric SMILES

CCCC1=C(C(=CC(=[N+]1[O-])C)OCC(C)C)C(=O)NC2=CC=CC(=C2C)C

InChI

InChI=1S/C22H30N2O3/c1-7-9-19-21(20(27-13-14(2)3)12-16(5)24(19)26)22(25)23-18-11-8-10-15(4)17(18)6/h8,10-12,14H,7,9,13H2,1-6H3,(H,23,25)