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

Systemtic Name: N-(2,3-dimethylphenyl)-4-hexoxy-2,6-dimethyl-1-oxidanidyl-pyridin-1-ium-3-carboxamide Openeye Name: N-(2,3-dimethylphenyl)-4-hexoxy-2,6-dimethyl-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: N-(2,3-dimethylphenyl)-4-hexoxy-2,6-dimethyl-1-oxido-3-pyridin-1-iumcarboxamide IUPAC Name: N-(2,3-dimethylphenyl)-4-hexoxy-2,6-dimethyl-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: N-(2,3-dimethylphenyl)-4-hexoxy-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:

CCCCCCOC1=CC(=[N+](C(=C1C(=O)NC2=CC=CC(=C2C)C)C)[O-])C

Isomeric SMILES

CCCCCCOC1=CC(=[N+](C(=C1C(=O)NC2=CC=CC(=C2C)C)C)[O-])C

InChI

InChI=1S/C22H30N2O3/c1-6-7-8-9-13-27-20-14-16(3)24(26)18(5)21(20)22(25)23-19-12-10-11-15(2)17(19)4/h10-12,14H,6-9,13H2,1-5H3,(H,23,25)