1-(3-nitrophenyl)-N-(pyridin-4-ylmethyl)methanesulfonamide

Systemtic Name: 1-(3-nitrophenyl)-N-(pyridin-4-ylmethyl)methanesulfonamide Openeye Name: 1-(3-nitrophenyl)-N-(4-pyridylmethyl)methanesulfonamide CAS Name: 1-(3-nitrophenyl)-N-(pyridin-4-ylmethyl)methanesulfonamide IUPAC Name: 1-(3-nitrophenyl)-N-(pyridin-4-ylmethyl)methanesulfonamide Traditional Name: 1-(3-nitrophenyl)-N-(4-pyridylmethyl)methanesulfonamide Formula: C13H13N3O4S MolecularWeight: 307.32502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13N3O4S/c17-16(18)13-3-1-2-12(8-13)10-21(19,20)15-9-11-4-6-14-7-5-11/h1-8,15H,9-10H2