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

Systemtic Name: 4-butoxy-N-(2,3-dimethylphenyl)-6-methyl-1-oxidanidyl-2-(phenylmethyl)pyridin-1-ium-3-carboxamide Openeye Name: 2-benzyl-4-butoxy-N-(2,3-dimethylphenyl)-6-methyl-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: 4-butoxy-N-(2,3-dimethylphenyl)-6-methyl-1-oxido-2-(phenylmethyl)-3-pyridin-1-iumcarboxamide IUPAC Name: 2-benzyl-4-butoxy-N-(2,3-dimethylphenyl)-6-methyl-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: 2-benzyl-4-butoxy-N-(2,3-dimethylphenyl)-6-methyl-1-oxido-pyridin-1-ium-3-carboxamide Formula: C26H30N2O3 MolecularWeight: 418.528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=[N+](C(=C1C(=O)NC2=CC=CC(=C2C)C)CC3=CC=CC=C3)[O-])C

Isomeric SMILES

CCCCOC1=CC(=[N+](C(=C1C(=O)NC2=CC=CC(=C2C)C)CC3=CC=CC=C3)[O-])C

InChI

InChI=1S/C26H30N2O3/c1-5-6-15-31-24-16-19(3)28(30)23(17-21-12-8-7-9-13-21)25(24)26(29)27-22-14-10-11-18(2)20(22)4/h7-14,16H,5-6,15,17H2,1-4H3,(H,27,29)