N-[4-[2-(4-nitroindazol-1-yl)carbonylhydrazinyl]phenyl]-3-[(4-octylphenyl)sulfonylamino]benzenesulfonamide

Systemtic Name: N-[4-[2-(4-nitroindazol-1-yl)carbonylhydrazinyl]phenyl]-3-[(4-octylphenyl)sulfonylamino]benzenesulfonamide Openeye Name: N-[4-[2-(4-nitroindazole-1-carbonyl)hydrazino]phenyl]-3-[(4-octylphenyl)sulfonylamino]benzenesulfonamide CAS Name: N-[4-[[(4-nitro-1-indazolyl)-oxomethyl]hydrazo]phenyl]-3-[(4-octylphenyl)sulfonylamino]benzenesulfonamide IUPAC Name: N-[4-[2-(4-nitroindazole-1-carbonyl)hydrazinyl]phenyl]-3-[(4-octylphenyl)sulfonylamino]benzenesulfonamide Traditional Name: N-[4-[N'-(4-nitroindazole-1-carbonyl)hydrazino]phenyl]-3-[(4-octylphenyl)sulfonylamino]benzenesulfonamide Formula: C34H37N7O7S2 MolecularWeight: 719.83028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC=C2)S(=O)(=O)NC3=CC=C(C=C3)NNC(=O)N4C5=C(C=N4)C(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC=C2)S(=O)(=O)NC3=CC=C(C=C3)NNC(=O)N4C5=C(C=N4)C(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C34H37N7O7S2/c1-2-3-4-5-6-7-10-25-15-21-29(22-16-25)49(45,46)39-28-11-8-12-30(23-28)50(47,48)38-27-19-17-26(18-20-27)36-37-34(42)40-32-13-9-14-33(41(43)44)31(32)24-35-40/h8-9,11-24,36,38-39H,2-7,10H2,1H3,(H,37,42)