2-methyl-5-nitro-N-[4-(pyridin-4-ylmethyl)phenyl]benzenesulfonamide

Systemtic Name: 2-methyl-5-nitro-N-[4-(pyridin-4-ylmethyl)phenyl]benzenesulfonamide Openeye Name: 2-methyl-5-nitro-N-[4-(4-pyridylmethyl)phenyl]benzenesulfonamide CAS Name: 2-methyl-5-nitro-N-[4-(pyridin-4-ylmethyl)phenyl]benzenesulfonamide IUPAC Name: 2-methyl-5-nitro-N-[4-(pyridin-4-ylmethyl)phenyl]benzenesulfonamide Traditional Name: 2-methyl-5-nitro-N-[4-(4-pyridylmethyl)phenyl]benzenesulfonamide Formula: C19H17N3O4S MolecularWeight: 383.42098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3

InChI

InChI=1S/C19H17N3O4S/c1-14-2-7-18(22(23)24)13-19(14)27(25,26)21-17-5-3-15(4-6-17)12-16-8-10-20-11-9-16/h2-11,13,21H,12H2,1H3