3-nitro-N-(pyridin-4-ylmethyl)benzenesulfonamide

Systemtic Name: 3-nitro-N-(pyridin-4-ylmethyl)benzenesulfonamide Openeye Name: 3-nitro-N-(4-pyridylmethyl)benzenesulfonamide CAS Name: 3-nitro-N-(pyridin-4-ylmethyl)benzenesulfonamide IUPAC Name: 3-nitro-N-(pyridin-4-ylmethyl)benzenesulfonamide Traditional Name: 3-nitro-N-(4-pyridylmethyl)benzenesulfonamide Formula: C12H11N3O4S MolecularWeight: 293.29844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NCC2=CC=NC=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NCC2=CC=NC=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H11N3O4S/c16-15(17)11-2-1-3-12(8-11)20(18,19)14-9-10-4-6-13-7-5-10/h1-8,14H,9H2