N-(2-ethyl-6-methyl-phenyl)-2-(4-pentan-3-ylpyridin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-2-(4-pentan-3-ylpyridin-1-ium-1-yl)ethanamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]acetamide CAS Name: N-(2-ethyl-6-methylphenyl)-2-(4-pentan-3-yl-1-pyridin-1-iumyl)acetamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-2-(4-pentan-3-ylpyridin-1-ium-1-yl)acetamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]acetamide Formula: C21H29N2O+ MolecularWeight: 325.46776

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C[N+]2=CC=C(C=C2)C(CC)CC)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C[N+]2=CC=C(C=C2)C(CC)CC)C

InChI

InChI=1S/C21H28N2O/c1-5-17(6-2)19-11-13-23(14-12-19)15-20(24)22-21-16(4)9-8-10-18(21)7-3/h8-14,17H,5-7,15H2,1-4H3/p+1