N-(2-cyclopentylethyl)-2-[6-(4-ethoxyphenyl)-1-oxidanidyl-pyridin-1-ium-3-yl]ethanamide

Systemtic Name: N-(2-cyclopentylethyl)-2-[6-(4-ethoxyphenyl)-1-oxidanidyl-pyridin-1-ium-3-yl]ethanamide Openeye Name: N-(2-cyclopentylethyl)-2-[6-(4-ethoxyphenyl)-1-oxido-pyridin-1-ium-3-yl]acetamide CAS Name: N-(2-cyclopentylethyl)-2-[6-(4-ethoxyphenyl)-1-oxido-3-pyridin-1-iumyl]acetamide IUPAC Name: N-(2-cyclopentylethyl)-2-[6-(4-ethoxyphenyl)-1-oxidopyridin-1-ium-3-yl]acetamide Traditional Name: N-(2-cyclopentylethyl)-2-(1-oxido-6-p-phenetyl-pyridin-1-ium-3-yl)acetamide Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=[N+](C=C(C=C2)CC(=O)NCCC3CCCC3)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=[N+](C=C(C=C2)CC(=O)NCCC3CCCC3)[O-]

InChI

InChI=1S/C22H28N2O3/c1-2-27-20-10-8-19(9-11-20)21-12-7-18(16-24(21)26)15-22(25)23-14-13-17-5-3-4-6-17/h7-12,16-17H,2-6,13-15H2,1H3,(H,23,25)