N-(5-chloranyl-2-methyl-phenyl)-2-[4-[(4-nitrophenyl)methyl]pyridin-1-ium-1-yl]ethanamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-2-[4-[(4-nitrophenyl)methyl]pyridin-1-ium-1-yl]ethanamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-2-[4-[(4-nitrophenyl)methyl]pyridin-1-ium-1-yl]acetamide CAS Name: N-(5-chloro-2-methylphenyl)-2-[4-[(4-nitrophenyl)methyl]-1-pyridin-1-iumyl]acetamide IUPAC Name: N-(5-chloro-2-methylphenyl)-2-[4-[(4-nitrophenyl)methyl]pyridin-1-ium-1-yl]acetamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-2-[4-(4-nitrobenzyl)pyridin-1-ium-1-yl]acetamide Formula: C21H19ClN3O3+ MolecularWeight: 396.84686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=O)C[N+]2=CC=C(C=C2)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=O)C[N+]2=CC=C(C=C2)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H18ClN3O3/c1-15-2-5-18(22)13-20(15)23-21(26)14-24-10-8-17(9-11-24)12-16-3-6-19(7-4-16)25(27)28/h2-11,13H,12,14H2,1H3/p+1