4-chloranyl-N-(4,6-dimethylpyridin-1-ium-2-yl)-2-nitro-benzamide

Systemtic Name: 4-chloranyl-N-(4,6-dimethylpyridin-1-ium-2-yl)-2-nitro-benzamide Openeye Name: 4-chloro-N-(4,6-dimethylpyridin-1-ium-2-yl)-2-nitro-benzamide CAS Name: 4-chloro-N-(4,6-dimethyl-2-pyridin-1-iumyl)-2-nitrobenzamide IUPAC Name: 4-chloro-N-(4,6-dimethylpyridin-1-ium-2-yl)-2-nitrobenzamide Traditional Name: 4-chloro-N-(4,6-dimethylpyridin-1-ium-2-yl)-2-nitro-benzamide Formula: C14H13ClN3O3+ MolecularWeight: 306.72432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12ClN3O3/c1-8-5-9(2)16-13(6-8)17-14(19)11-4-3-10(15)7-12(11)18(20)21/h3-7H,1-2H3,(H,16,17,19)/p+1