5-nitro-2-(pyridin-3-ylmethylamino)benzenesulfonamide

Systemtic Name: 5-nitro-2-(pyridin-3-ylmethylamino)benzenesulfonamide Openeye Name: 5-nitro-2-(3-pyridylmethylamino)benzenesulfonamide CAS Name: 5-nitro-2-(3-pyridinylmethylamino)benzenesulfonamide IUPAC Name: 5-nitro-2-(pyridin-3-ylmethylamino)benzenesulfonamide Traditional Name: 5-nitro-2-(3-pyridylmethylamino)benzenesulfonamide Formula: C12H12N4O4S MolecularWeight: 308.31308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N

Isomeric SMILES

C1=CC(=CN=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N

InChI

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