N-[3-[(4-chloranylpyrazol-1-yl)methyl]phenyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[3-[(4-chloranylpyrazol-1-yl)methyl]phenyl]-3-nitro-benzenesulfonamide Openeye Name: N-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]-3-nitro-benzenesulfonamide CAS Name: N-[3-[(4-chloro-1-pyrazolyl)methyl]phenyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]-3-nitrobenzenesulfonamide Traditional Name: N-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]-3-nitro-benzenesulfonamide Formula: C16H13ClN4O4S MolecularWeight: 392.81682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])CN3C=C(C=N3)Cl

Isomeric SMILES

C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])CN3C=C(C=N3)Cl

InChI

InChI=1S/C16H13ClN4O4S/c17-13-9-18-20(11-13)10-12-3-1-4-14(7-12)19-26(24,25)16-6-2-5-15(8-16)21(22)23/h1-9,11,19H,10H2