1-phenacyl-N-(phenylsulfonyl)pyridin-1-ium-3-carbohydrazide bromide

Systemtic Name: 1-phenacyl-N-(phenylsulfonyl)pyridin-1-ium-3-carbohydrazide bromide Openeye Name: N-(benzenesulfonyl)-1-phenacyl-pyridin-1-ium-3-carbohydrazide bromide CAS Name: N-(benzenesulfonyl)-1-phenacyl-3-pyridin-1-iumcarbohydrazide bromide IUPAC Name: N-(benzenesulfonyl)-1-phenacylpyridin-1-ium-3-carbohydrazide bromide Traditional Name: N-besyl-1-phenacyl-pyridin-1-ium-3-carbohydrazide bromide Formula: C20H18BrN3O4S MolecularWeight: 476.34362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C[N+]2=CC=CC(=C2)C(=O)N(N)S(=O)(=O)C3=CC=CC=C3.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C[N+]2=CC=CC(=C2)C(=O)N(N)S(=O)(=O)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C20H18N3O4S.BrH/c21-23(28(26,27)18-11-5-2-6-12-18)20(25)17-10-7-13-22(14-17)15-19(24)16-8-3-1-4-9-16;/h1-14H,15,21H2;1H/q+1;/p-1