N-(2-chloranyl-4-nitro-phenyl)-2-(4-pentan-3-ylpyridin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2-chloranyl-4-nitro-phenyl)-2-(4-pentan-3-ylpyridin-1-ium-1-yl)ethanamide Openeye Name: N-(2-chloro-4-nitro-phenyl)-2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]acetamide CAS Name: N-(2-chloro-4-nitrophenyl)-2-(4-pentan-3-yl-1-pyridin-1-iumyl)acetamide IUPAC Name: N-(2-chloro-4-nitrophenyl)-2-(4-pentan-3-ylpyridin-1-ium-1-yl)acetamide Traditional Name: N-(2-chloro-4-nitro-phenyl)-2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]acetamide Formula: C18H21ClN3O3+ MolecularWeight: 362.83064

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=CC=[N+](C=C1)CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCC(CC)C1=CC=[N+](C=C1)CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H20ClN3O3/c1-3-13(4-2)14-7-9-21(10-8-14)12-18(23)20-17-6-5-15(22(24)25)11-16(17)19/h5-11,13H,3-4,12H2,1-2H3/p+1