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

Systemtic Name: 4-azanyl-3-nitro-N-(pyridin-4-ylmethyl)benzenesulfonamide Openeye Name: 4-amino-3-nitro-N-(4-pyridylmethyl)benzenesulfonamide CAS Name: 4-amino-3-nitro-N-(pyridin-4-ylmethyl)benzenesulfonamide IUPAC Name: 4-amino-3-nitro-N-(pyridin-4-ylmethyl)benzenesulfonamide Traditional Name: 4-amino-3-nitro-N-(4-pyridylmethyl)benzenesulfonamide Formula: C12H12N4O4S MolecularWeight: 308.31308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)NCC2=CC=NC=C2)[N+](=O)[O-])N

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)NCC2=CC=NC=C2)[N+](=O)[O-])N

InChI

InChI=1S/C12H12N4O4S/c13-11-2-1-10(7-12(11)16(17)18)21(19,20)15-8-9-3-5-14-6-4-9/h1-7,15H,8,13H2