N-(2,3-dimethylphenyl)-2,6-dimethyl-1-oxidanidyl-4-pentoxy-pyridin-1-ium-3-carboxamide

Systemtic Name: N-(2,3-dimethylphenyl)-2,6-dimethyl-1-oxidanidyl-4-pentoxy-pyridin-1-ium-3-carboxamide Openeye Name: N-(2,3-dimethylphenyl)-2,6-dimethyl-1-oxido-4-pentoxy-pyridin-1-ium-3-carboxamide CAS Name: N-(2,3-dimethylphenyl)-2,6-dimethyl-1-oxido-4-pentoxy-3-pyridin-1-iumcarboxamide IUPAC Name: N-(2,3-dimethylphenyl)-2,6-dimethyl-1-oxido-4-pentoxypyridin-1-ium-3-carboxamide Traditional Name: 4-amoxy-N-(2,3-dimethylphenyl)-2,6-dimethyl-1-oxido-pyridin-1-ium-3-carboxamide Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC(=[N+](C(=C1C(=O)NC2=CC=CC(=C2C)C)C)[O-])C

Isomeric SMILES

CCCCCOC1=CC(=[N+](C(=C1C(=O)NC2=CC=CC(=C2C)C)C)[O-])C

InChI

InChI=1S/C21H28N2O3/c1-6-7-8-12-26-19-13-15(3)23(25)17(5)20(19)21(24)22-18-11-9-10-14(2)16(18)4/h9-11,13H,6-8,12H2,1-5H3,(H,22,24)